A0A060YFT4_ONCMY Loading...

Ubiquitin-ribosomal protein eS31 fusion protein

Component of the 40S subunit of the ribosome. Part of the small subunit (SSU) processome, first precursor of the small eukaryotic ribosomal subunit. During the assembly of the SSU processome in the nucleolus, many ribosome biogenesis factors, an RNA chaperone and ribosomal proteins associate with the nascent pre-rRNA and work in concert to generate RNA folding, modifications, rearrangements and cleavage as well as targeted degradation of pre-ribosomal RNA by the RNA exosome.

AlphaFold DB (Q7SXA3), UniProt , Accession A0A060YFT4, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110530107, Length 156 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M90.5Very high91.8Very high70 Ų7067.8 Ų67.835%0.34537%0.368SS..  0157.2062.7-179.8-174.800110V17 P19 L56 K63M1-V17 HydrophobicContact CE-CG2 3.82Å; M1-V17 HydrophobicContact CG-CG2 3.87Å; M1-V17 WeakPolarHBondContact CG-O 3.39Å; M1-V17 PolarHBondContact N-O 3.05Å; M1-V17 PolarHBondContact O-N 3.05Å; M1-P19 HydrophobicContact CE-CB 4.16Å; M1-P19 HydrophobicContact SD-CB 4.42Å; M1-L56 HydrophobicContact CE-CB 3.91Å; M1-L56 HydrophobicContact CE-CD1 3.54Å; M1-L56 HydrophobicContact CE-CG 4.36Å; M1-K63 HydrophobicContact CB-CB 4.36Å
2Q91.6Very high91.9Very high88 Ų8867.9 Ų67.941%0.41137%0.372SS..EExtended strand (participates in β ladder)trans-106.6134.9177.7-76.8-179.2-2.700110.4L15 E16 E64Q2-L15 WeakPolarHBondContact CA-O 3.45Å; Q2-E16 HydrophobicContact CG-CG 4.13Å; Q2-E16 PolarHBondContact NE2-OE1 3.16Å; Q2-E64 PolarHBondContact O-N 3.5Å
3I94.7Very high92Very high0 Ų063.5 Ų63.50%035%0.348CS..EExtended strand (participates in β ladder)trans-125.1157.9173.963.9169.2000110L15 V17 V26 I61 L67I3-L15 HydrophobicContact CG1-CB 3.95Å; I3-L15 PolarHBondContact N-O 2.95Å; I3-L15 PolarHBondContact O-N 3.32Å; I3-V17 HydrophobicContact CB-CG2 4.38Å; I3-V17 HydrophobicContact CD1-CG1 4.01Å; I3-V17 HydrophobicContact CD1-CG2 3.88Å; I3-V17 HydrophobicContact CG1-CG1 4.23Å; I3-V17 HydrophobicContact CG1-CG2 3.78Å; I3-V17 HydrophobicContact CG2-CG2 3.79Å; I3-V26 HydrophobicContact CD1-CG1 4.19Å; I3-I61 HydrophobicContact CG2-CG2 4.04Å; I3-L67 HydrophobicContact CD1-CD1 3.8Å
4F94.8Very high92.2Very high59 Ų5964.4 Ų64.426%0.25936%0.356SS..EExtended strand (participates in β ladder)trans-112.8132.1179-60.5-79.5000110.2T12 I13 T14 E64 S65 T66 L67F4-T12 HydrophobicContact CB-CG2 3.9Å; F4-T12 HydrophobicContact CD1-CG2 3.86Å; F4-T12 HydrophobicContact CG-CG2 4.28Å; F4-I13 CarbonylContact C-O 3.57Å; F4-I13 WeakPolarHBondContact CA-O 3.09Å; F4-T14 HydrophobicContact CD1-CG2 3.77Å; F4-T14 HydrophobicContact CE1-CG2 3.63Å; F4-E64 HydrophobicContact CE2-CB 3.98Å; F4-E64 HydrophobicContact CE2-CG 3.93Å; F4-S65 PolarHBondContact N-O 2.8Å; F4-T66 HydrophobicContact CB-CG2 4.07Å; F4-T66 CarbonylContact O-C 3.53Å; F4-T66 VanDerWaalsContact O-CA 3.28Å; F4-T66 WeakPolarHBondContact O-CA 3.43Å; F4-L67 PolarHBondContact O-N 2.8Å
5V94.7Very high92.3Very high0 Ų060.3 Ų60.30%033%0.333CS..EExtended strand (participates in β ladder)trans-112.5113.4174.6-176.90000108.6T12 I13 L15 I30 L43 L67 L69V5-T12 WeakPolarHBondContact O-CA 3.31Å; V5-I13 HydrophobicContact CB-CB 4.32Å; V5-I13 PolarHBondContact N-O 3.31Å; V5-I13 PolarHBondContact O-N 3.02Å; V5-L15 HydrophobicContact CG2-CD1 3.61Å; V5-L15 HydrophobicContact CG2-CG 4.36Å; V5-I30 HydrophobicContact CG1-CD1 4.16Å; V5-I30 HydrophobicContact CG2-CD1 4.12Å; V5-L43 HydrophobicContact CG1-CD2 4.31Å; V5-L67 CarbonylContact C-O 3.52Å; V5-L67 WeakPolarHBondContact CA-O 3.15Å; V5-L67 HydrophobicContact CG2-CB 4.31Å; V5-L69 HydrophobicContact CG1-CB 3.55Å; V5-L69 HydrophobicContact CG1-CD2 4.47Å
6K95Very high92.3Very high87 Ų8765.4 Ų65.438%0.37835%0.354SS..EExtended strand (participates in β ladder)trans-91.4121.5175.7-72-174.6176.2178.80109.9K11 T12 L67 H68 L69K6-K11 WeakPolarHBondContact CA-O 3.42Å; K6-T12 HydrophobicContact CG-CG2 4.34Å; K6-L67 PolarHBondContact N-O 2.86Å; K6-H68 WeakPolarHBondContact O-CA 3.46Å; K6-L69 PolarHBondContact O-N 2.89Å
7T91.8Very high92.4Very high19 Ų1961.8 Ų61.812%0.11734%0.335CS..EExtended strand (participates in β ladder)trans-78164.6172.169.10000110.7T9 G10 K11 I13 L69T7-T9 PolarHBondContact O-N 2.88Å; T7-T9 PolarHBondContact OG1-N 2.95Å; T7-T9 PolarHBondContact OG1-OG1 3.45Å; T7-G10 PolarHBondContact O-N 3Å; T7-K11 HydrophobicContact CG2-CB 4.35Å; T7-K11 PolarHBondContact N-O 3.29Å; T7-K11 WeakPolarHBondContact OG1-CB 3.42Å; T7-K11 PolarHBondContact OG1-N 2.75Å; T7-K11 PolarHBondContact OG1-O 3.44Å; T7-I13 HydrophobicContact CG2-CD1 3.91Å; T7-L69 HydrophobicContact CG2-CD2 4.31Å
8L87.9Confident92.4Very high132 Ų13265.1 Ų65.169%0.69135%0.347SS*.THydrogen-bonded Turntrans-58.5-24.1171.5-69.2176.2000113.8G10 V70L8-G10 VanDerWaalsContact C-N 3.28Å; L8-V70 HydrophobicContact CD1-CG1 4.25Å; L8-V70 HydrophobicContact CD2-CG2 4.05Å; L8-V70 HydrophobicContact CG-CG2 4.44Å
9T87.5Confident92.3Very high126 Ų12665.3 Ų65.377%0.77335%0.353SS*.THydrogen-bonded Turntrans-84.30.6178.455.80000113.4T7 K11T7-T9 PolarHBondContact O-N 2.88Å; T7-T9 PolarHBondContact OG1-N 2.95Å; T7-T9 PolarHBondContact OG1-OG1 3.45Å; T9-K11 VanDerWaalsContact C-N 3.32Å
10G88.9Confident92.3Very high59 Ų5965.6 Ų65.661%0.60836%0.36SS*.SBendtrans84.8-1.1-178.700000114.7T7 L8T7-G10 PolarHBondContact O-N 3Å; L8-G10 VanDerWaalsContact C-N 3.28Å
11K92.1Very high92.3Very high106 Ų10663.4 Ų63.446%0.46135%0.348SS..  trans-68.7132.9173.9-172.8-179.7172-1670109.2K6 T7 T9 E34K6-K11 WeakPolarHBondContact CA-O 3.42Å; T7-K11 HydrophobicContact CG2-CB 4.35Å; T7-K11 PolarHBondContact N-O 3.29Å; T7-K11 WeakPolarHBondContact OG1-CB 3.42Å; T7-K11 PolarHBondContact OG1-N 2.75Å; T7-K11 PolarHBondContact OG1-O 3.44Å; T9-K11 VanDerWaalsContact C-N 3.32Å; K11-E34 VanDerWaalsContact CE-OE1 3.25Å; K11-E34 WeakPolarHBondContact CE-OE1 3.28Å; K11-E34 IonicContact NZ-OE1 2.97Å; K11-E34 PolarHBondContact NZ-OE1 3.43Å; K11-E34 IonicContact NZ-OE2 2.96Å; K11-E34 PolarHBondContact NZ-OE2 2.96Å
12T93.6Very high92.5Very high69 Ų6962 Ų6242%0.42334%0.343SS..EExtended strand (participates in β ladder)trans-107.1124.7176.8-55.70000109.2F4 V5 K6F4-T12 HydrophobicContact CB-CG2 3.9Å; F4-T12 HydrophobicContact CD1-CG2 3.86Å; F4-T12 HydrophobicContact CG-CG2 4.28Å; V5-T12 WeakPolarHBondContact O-CA 3.31Å; K6-T12 HydrophobicContact CG-CG2 4.34Å
13I92.6Very high92.6Very high11 Ų1157.8 Ų57.86%0.05632%0.323CS..EExtended strand (participates in β ladder)trans-107.5128179.9-53.8157.4000107.7F4 V5 T7 L15 K33 E34F4-I13 CarbonylContact C-O 3.57Å; F4-I13 WeakPolarHBondContact CA-O 3.09Å; V5-I13 HydrophobicContact CB-CB 4.32Å; V5-I13 PolarHBondContact N-O 3.31Å; V5-I13 PolarHBondContact O-N 3.02Å; T7-I13 HydrophobicContact CG2-CD1 3.91Å; I13-L15 HydrophobicContact CG2-CD2 4.23Å; I13-L15 HydrophobicContact CG2-CG 4.39Å; I13-K33 HydrophobicContact CG2-CB 4.45Å; I13-K33 HydrophobicContact CG2-CD 3.77Å; I13-E34 HydrophobicContact CD1-CG 3.32Å; I13-E34 WeakPolarHBondContact CD1-OE1 3.27Å; I13-E34 HydrophobicContact CG1-CG 4.34Å
14T94.6Very high92.6Very high76 Ų7663.5 Ų63.547%0.46635%0.35SS..EExtended strand (participates in β ladder)trans-87.7133.4173.251.90000109.7F4 K33F4-T14 HydrophobicContact CD1-CG2 3.77Å; F4-T14 HydrophobicContact CE1-CG2 3.63Å; T14-K33 PolarHBondContact O-NZ 3.02Å
15L93.6Very high92.6Very high2 Ų264.2 Ų64.21%0.0136%0.357CS..EExtended strand (participates in β ladder)trans-128.2138.5175.5-64.9174.3000110.8Q2 I3 V5 I13 V17 V26 K29 I30 K33Q2-L15 WeakPolarHBondContact CA-O 3.45Å; I3-L15 HydrophobicContact CG1-CB 3.95Å; I3-L15 PolarHBondContact N-O 2.95Å; I3-L15 PolarHBondContact O-N 3.32Å; V5-L15 HydrophobicContact CG2-CD1 3.61Å; V5-L15 HydrophobicContact CG2-CG 4.36Å; I13-L15 HydrophobicContact CG2-CD2 4.23Å; I13-L15 HydrophobicContact CG2-CG 4.39Å; L15-V17 HydrophobicContact CB-CG1 4.15Å; L15-V26 HydrophobicContact CD1-CG1 4.12Å; L15-K29 HydrophobicContact CD2-CB 4.2Å; L15-I30 HydrophobicContact CD1-CD1 4.12Å; L15-I30 HydrophobicContact CD1-CG1 3.53Å; L15-K33 HydrophobicContact CD2-CD 3.7Å
16E93.4Very high92.5Very high142 Ų14264.2 Ų64.266%0.66436%0.357SS*.EExtended strand (participates in β ladder)trans-94.4118.2170.4-65.5-171.4161.900109.1Q2 K29Q2-E16 HydrophobicContact CG-CG 4.13Å; Q2-E16 PolarHBondContact NE2-OE1 3.16Å; E16-K29 PolarHBondContact O-NZ 3.25Å
17V93.1Very high92.5Very high4 Ų460.2 Ų60.22%0.02434%0.339CS..  trans-138.5155.5-172.5-62.50000110.3M1 I3 L15 D21 V26 K29 L56M1-V17 HydrophobicContact CE-CG2 3.82Å; M1-V17 HydrophobicContact CG-CG2 3.87Å; M1-V17 WeakPolarHBondContact CG-O 3.39Å; M1-V17 PolarHBondContact N-O 3.05Å; M1-V17 PolarHBondContact O-N 3.05Å; I3-V17 HydrophobicContact CB-CG2 4.38Å; I3-V17 HydrophobicContact CD1-CG1 4.01Å; I3-V17 HydrophobicContact CD1-CG2 3.88Å; I3-V17 HydrophobicContact CG1-CG1 4.23Å; I3-V17 HydrophobicContact CG1-CG2 3.78Å; I3-V17 HydrophobicContact CG2-CG2 3.79Å; L15-V17 HydrophobicContact CB-CG1 4.15Å; V17-D21 WeakPolarHBondContact CA-OD2 3.42Å; V17-V26 HydrophobicContact CG1-CG2 4.1Å; V17-K29 HydrophobicContact CG1-CD 4.18Å; V17-L56 HydrophobicContact CB-CD1 3.72Å; V17-L56 HydrophobicContact CG1-CD1 4.34Å; V17-L56 HydrophobicContact CG2-CD1 3.5Å
18E92.6Very high92.6Very high121 Ų12161.1 Ų61.157%0.56535%0.349SS*.  trans-101.4150.5169.8-66-172173.200110.1S20 D21E18-S20 WeakPolarHBondContact CB-OG 3.34Å; E18-S20 PolarHBondContact O-N 2.79Å; E18-S20 VanDerWaalsContact O-N 3.16Å; E18-S20 PolarHBondContact OE2-OG 2.96Å; E18-D21 PolarHBondContact N-OD2 3.44Å; E18-D21 VanDerWaalsContact O-CB 3.31Å; E18-D21 WeakPolarHBondContact O-CB 3.38Å; E18-D21 PolarHBondContact O-N 3.21Å
19P90.5Very high92.8Very high69 Ų6958.1 Ų58.145%0.44833%0.33SS..THydrogen-bonded Turntrans-60.2-24.717824.4-33.6000113.2M1 D21 S57M1-P19 HydrophobicContact CE-CB 4.16Å; M1-P19 HydrophobicContact SD-CB 4.42Å; P19-D21 VanDerWaalsContact C-N 3.34Å; P19-S57 PolarHBondContact O-N 3.32Å; P19-S57 PolarHBondContact O-OG 2.85Å; P19-S57 VanDerWaalsContact O-OG 3.14Å
20S92Very high93.1Very high71 Ų7152.1 Ų52.150%0.49729%0.293SS..THydrogen-bonded Turntrans-74.9-15.2173.343.30000114.3E18 T22E18-S20 WeakPolarHBondContact CB-OG 3.34Å; E18-S20 PolarHBondContact O-N 2.79Å; E18-S20 VanDerWaalsContact O-N 3.16Å; E18-S20 PolarHBondContact OE2-OG 2.96Å; S20-T22 PolarHBondContact O-N 2.69Å
21D93.3Very high93.3Very high21 Ų2153 Ų5311%0.11228%0.282CS..  trans-62.8135.1179.5-82.8-31.2000110.3V17 E18 P19 N25 V26 K29 T55 L56V17-D21 WeakPolarHBondContact CA-OD2 3.42Å; E18-D21 PolarHBondContact N-OD2 3.44Å; E18-D21 VanDerWaalsContact O-CB 3.31Å; E18-D21 WeakPolarHBondContact O-CB 3.38Å; E18-D21 PolarHBondContact O-N 3.21Å; P19-D21 VanDerWaalsContact C-N 3.34Å; D21-N25 HydrophobicContact CB-CB 4.36Å; D21-V26 HydrophobicContact CB-CG2 4.46Å; D21-K29 IonicContact OD2-NZ 2.8Å; D21-K29 PolarHBondContact OD2-NZ 2.91Å; D21-T55 WeakPolarHBondContact O-CA 3.03Å; D21-L56 HydrophobicContact CB-CD1 4.35Å; D21-L56 PolarHBondContact O-N 3.44Å
22T94.7Very high93.3Very high39 Ų3954.5 Ų54.524%0.23930%0.295CS..BIsolated β-bridgetrans-73.5157.1171.161.40000110.7S20 E24 N25 V26 R54S20-T22 PolarHBondContact O-N 2.69Å; T22-E24 PolarHBondContact O-N 2.96Å; T22-N25 WeakPolarHBondContact O-CB 3.34Å; T22-N25 PolarHBondContact O-N 3.47Å; T22-N25 VanDerWaalsContact O-N 3.08Å; T22-N25 PolarHBondContact OG1-N 3.01Å; T22-N25 PolarHBondContact OG1-OD1 3.38Å; T22-V26 PolarHBondContact O-N 3.49Å; T22-V26 VanDerWaalsContact O-N 3.09Å; T22-R54 CarbonylContact C-O 3.6Å; T22-R54 WeakPolarHBondContact CA-O 3.41Å
23I94.3Very high93.1Very high0 Ų056.6 Ų56.60%030%0.298CS..Hα-helixtrans-60.1-32.6173.8-61.5-54.8000111.3V26 K27 L43 L50 E51 R54 L56 Y59I23-V26 PolarHBondContact O-N 3.28Å; I23-K27 WeakPolarHBondContact O-CG 3.48Å; I23-K27 PolarHBondContact O-N 3.22Å; I23-L43 HydrophobicContact CG2-CD1 4.22Å; I23-L50 HydrophobicContact CD1-CB 4.06Å; I23-L50 HydrophobicContact CD1-CD1 3.61Å; I23-L50 HydrophobicContact CD1-CG 4.38Å; I23-L50 HydrophobicContact CG1-CB 3.96Å; I23-L50 HydrophobicContact CG1-CD1 4.44Å; I23-L50 HydrophobicContact CG2-CB 3.84Å; I23-E51 VanDerWaalsContact CB-O 3.29Å; I23-E51 WeakPolarHBondContact CB-O 2.99Å; I23-E51 WeakPolarHBondContact CG1-O 3.46Å; I23-R54 WeakPolarHBondContact CG1-O 3.46Å; I23-R54 PolarHBondContact N-O 3.27Å; I23-L56 HydrophobicContact CD1-CD2 3.74Å; I23-Y59 HydrophobicContact CD1-CD2 4.44Å; I23-Y59 HydrophobicContact CG1-CE2 4.24Å
24E94.1Very high92.9Very high120 Ų12058.9 Ų58.956%0.56131%0.308SS*.Hα-helixtrans-59.5-46.2171.9-170.8169-159.100112.3T22 V26 K27 A28 D52T22-E24 PolarHBondContact O-N 2.96Å; E24-V26 VanDerWaalsContact C-N 3.31Å; E24-V26 PolarHBondContact O-N 2.82Å; E24-K27 PolarHBondContact O-N 2.8Å; E24-A28 PolarHBondContact O-N 3.26Å; E24-D52 HydrophobicContact CB-CB 4.33Å; E24-D52 PolarHBondContact N-O 3.05Å
25N93.6Very high92.7Very high75 Ų7558 Ų5840%0.40132%0.315SS..Hα-helixtrans-61.1-40.1175.3-67.8-6.1000111.7D21 T22 A28 K29D21-N25 HydrophobicContact CB-CB 4.36Å; T22-N25 WeakPolarHBondContact O-CB 3.34Å; T22-N25 PolarHBondContact O-N 3.47Å; T22-N25 VanDerWaalsContact O-N 3.08Å; T22-N25 PolarHBondContact OG1-N 3.01Å; T22-N25 PolarHBondContact OG1-OD1 3.38Å; N25-A28 PolarHBondContact O-N 3.27Å; N25-K29 WeakPolarHBondContact O-CG 3.44Å; N25-K29 PolarHBondContact O-N 2.98Å
26V93.7Very high92.5Very high0 Ų059.5 Ų59.50%032%0.323CS..Hα-helixtrans-64.2-40.8176.71790000111.1I3 L15 V17 D21 T22 I23 E24 K29 I30 L43 L56I3-V26 HydrophobicContact CD1-CG1 4.19Å; L15-V26 HydrophobicContact CD1-CG1 4.12Å; V17-V26 HydrophobicContact CG1-CG2 4.1Å; D21-V26 HydrophobicContact CB-CG2 4.46Å; T22-V26 PolarHBondContact O-N 3.49Å; T22-V26 VanDerWaalsContact O-N 3.09Å; I23-V26 PolarHBondContact O-N 3.28Å; E24-V26 VanDerWaalsContact C-N 3.31Å; E24-V26 PolarHBondContact O-N 2.82Å; V26-K29 PolarHBondContact O-N 3.4Å; V26-I30 HydrophobicContact CG1-CD1 4.23Å; V26-I30 WeakPolarHBondContact O-CG1 3.43Å; V26-I30 PolarHBondContact O-N 2.91Å; V26-L43 HydrophobicContact CB-CD1 4.47Å; V26-L43 HydrophobicContact CG1-CD1 3.97Å; V26-L56 HydrophobicContact CG2-CD1 3.94Å; V26-L56 HydrophobicContact CG2-CD2 4.12Å; V26-L56 HydrophobicContact CG2-CG 4.17Å
27K94.3Very high92.4Very high2 Ų254.7 Ų54.71%0.00930%0.304CS..Hα-helixtrans-64.9-37.6175.5-71.9179.4176.2-177.50112.7I23 E24 I30 Q31 P38 Q41 L43 D52I23-K27 WeakPolarHBondContact O-CG 3.48Å; I23-K27 PolarHBondContact O-N 3.22Å; E24-K27 PolarHBondContact O-N 2.8Å; K27-I30 PolarHBondContact O-N 2.8Å; K27-Q31 PolarHBondContact O-N 2.95Å; K27-P38 HydrophobicContact CB-CB 3.99Å; K27-P38 HydrophobicContact CD-CB 4.4Å; K27-Q41 VanDerWaalsContact CA-OE1 3.31Å; K27-Q41 HydrophobicContact CD-CB 4.28Å; K27-Q41 HydrophobicContact CG-CB 4.27Å; K27-Q41 PolarHBondContact NZ-O 3.49Å; K27-Q41 PolarHBondContact O-NE2 3.38Å; K27-Q41 PolarHBondContact O-OE1 3.2Å; K27-L43 HydrophobicContact CG-CD1 3.83Å; K27-L43 HydrophobicContact CG-CG 4.36Å; K27-D52 WeakPolarHBondContact CD-OD1 3.42Å; K27-D52 WeakPolarHBondContact CE-OD1 3.47Å; K27-D52 IonicContact NZ-OD1 2.68Å; K27-D52 PolarHBondContact NZ-OD1 2.82Å; K27-D52 IonicContact NZ-OD2 3.2Å; K27-D52 PolarHBondContact NZ-OD2 3.49Å
28A93.8Very high92.3Very high39 Ų3956.4 Ų56.432%0.32232%0.315SS..Hα-helixtrans-61.4-47.3173.100000111E24 N25 I30 Q31 D32E24-A28 PolarHBondContact O-N 3.26Å; N25-A28 PolarHBondContact O-N 3.27Å; A28-I30 PolarHBondContact O-N 2.78Å; A28-Q31 WeakPolarHBondContact O-CA 3.34Å; A28-Q31 VanDerWaalsContact O-CB 3.27Å; A28-Q31 WeakPolarHBondContact O-CB 3.41Å; A28-Q31 PolarHBondContact O-N 3.14Å; A28-D32 PolarHBondContact O-N 3.29Å
29K93.8Very high92.1Very high68 Ų6855.2 Ų55.230%0.29631%0.312SS..Hα-helixtrans-59.5-32174.7-69.5176.4177.9178.30113.1L15 E16 V17 D21 N25 V26L15-K29 HydrophobicContact CD2-CB 4.2Å; E16-K29 PolarHBondContact O-NZ 3.25Å; V17-K29 HydrophobicContact CG1-CD 4.18Å; D21-K29 IonicContact OD2-NZ 2.8Å; D21-K29 PolarHBondContact OD2-NZ 2.91Å; N25-K29 WeakPolarHBondContact O-CG 3.44Å; N25-K29 PolarHBondContact O-N 2.98Å; V26-K29 PolarHBondContact O-N 3.4Å
30I92.9Very high92Very high0 Ų056.3 Ų56.30%031%0.311CS..Hα-helixtrans-72.1-38.4173.2-67.8167.2000111.3V5 L15 V26 K27 A28 D32 K33 E34 L43 L69V5-I30 HydrophobicContact CG1-CD1 4.16Å; V5-I30 HydrophobicContact CG2-CD1 4.12Å; L15-I30 HydrophobicContact CD1-CD1 4.12Å; L15-I30 HydrophobicContact CD1-CG1 3.53Å; V26-I30 HydrophobicContact CG1-CD1 4.23Å; V26-I30 WeakPolarHBondContact O-CG1 3.43Å; V26-I30 PolarHBondContact O-N 2.91Å; K27-I30 PolarHBondContact O-N 2.8Å; A28-I30 PolarHBondContact O-N 2.78Å; I30-D32 VanDerWaalsContact C-N 3.28Å; I30-D32 PolarHBondContact O-N 3.09Å; I30-K33 PolarHBondContact O-N 3.17Å; I30-E34 PolarHBondContact O-N 2.95Å; I30-L43 HydrophobicContact CD1-CD1 4.02Å; I30-L43 HydrophobicContact CD1-CD2 3.61Å; I30-L43 HydrophobicContact CD1-CG 4.36Å; I30-L69 HydrophobicContact CG2-CD2 3.87Å
31Q93.2Very high92Very high79 Ų7953 Ų5337%0.36929%0.288SS..Hα-helixtrans-59.1-42.3175.4-179-176.97.400110.7K27 A28 K33 G35 I36 P38K27-Q31 PolarHBondContact O-N 2.95Å; A28-Q31 WeakPolarHBondContact O-CA 3.34Å; A28-Q31 VanDerWaalsContact O-CB 3.27Å; A28-Q31 WeakPolarHBondContact O-CB 3.41Å; A28-Q31 PolarHBondContact O-N 3.14Å; Q31-K33 VanDerWaalsContact C-N 3.26Å; Q31-K33 PolarHBondContact O-N 3.08Å; Q31-G35 WeakPolarHBondContact O-CA 3.36Å; Q31-G35 PolarHBondContact O-N 3.39Å; Q31-I36 WeakPolarHBondContact CA-O 3.25Å; Q31-I36 WeakPolarHBondContact CB-O 3.46Å; Q31-P38 HydrophobicContact CB-CG 4.49Å
32D92.2Very high92Very high136 Ų13656.6 Ų56.673%0.72730%0.3SS*.Hα-helixtrans-64.1-30.4179.1-63.8-32.5000112.9A28 I30A28-D32 PolarHBondContact O-N 3.29Å; I30-D32 VanDerWaalsContact C-N 3.28Å; I30-D32 PolarHBondContact O-N 3.09Å
33K90Very high92Very high113 Ų11354.7 Ų54.749%0.49129%0.288SS..Hα-helixtrans-90.9-42-178.2-66.7-164.4-178-166.20114.5I13 T14 L15 I30 Q31I13-K33 HydrophobicContact CG2-CB 4.45Å; I13-K33 HydrophobicContact CG2-CD 3.77Å; T14-K33 PolarHBondContact O-NZ 3.02Å; L15-K33 HydrophobicContact CD2-CD 3.7Å; I30-K33 PolarHBondContact O-N 3.17Å; Q31-K33 VanDerWaalsContact C-N 3.26Å; Q31-K33 PolarHBondContact O-N 3.08Å
34E88.3Confident92Very high59 Ų5957 Ų5728%0.27630%0.3SS..Hα-helixtrans-105.6-10.1-176.7-63.9-65.7127.800113.5K11 I13 I30 I36K11-E34 VanDerWaalsContact CE-OE1 3.25Å; K11-E34 WeakPolarHBondContact CE-OE1 3.28Å; K11-E34 IonicContact NZ-OE1 2.97Å; K11-E34 PolarHBondContact NZ-OE1 3.43Å; K11-E34 IonicContact NZ-OE2 2.96Å; K11-E34 PolarHBondContact NZ-OE2 2.96Å; I13-E34 HydrophobicContact CD1-CG 3.32Å; I13-E34 WeakPolarHBondContact CD1-OE1 3.27Å; I13-E34 HydrophobicContact CG1-CG 4.34Å; I30-E34 PolarHBondContact O-N 2.95Å; E34-I36 VanDerWaalsContact C-N 3.29Å; E34-I36 HydrophobicContact CB-CD1 3.88Å; E34-I36 HydrophobicContact CB-CG1 3.92Å; E34-I36 PolarHBondContact O-N 3.18Å
35G90.1Very high92Very high58 Ų5853.4 Ų53.460%0.59828%0.283SS*.  trans74.813.2-17700000114.5Q31 P37Q31-G35 WeakPolarHBondContact O-CA 3.36Å; Q31-G35 PolarHBondContact O-N 3.39Å; G35-P37 WeakPolarHBondContact O-CD 3.26Å
36I88.7Confident91.9Very high34 Ų3454 Ų5417%0.17430%0.298CS..  trans-92.6120.1-173.7-56.7175.3000109.7Q31 E34 Q40 Q41 L69 L71Q31-I36 WeakPolarHBondContact CA-O 3.25Å; Q31-I36 WeakPolarHBondContact CB-O 3.46Å; E34-I36 VanDerWaalsContact C-N 3.29Å; E34-I36 HydrophobicContact CB-CD1 3.88Å; E34-I36 HydrophobicContact CB-CG1 3.92Å; E34-I36 PolarHBondContact O-N 3.18Å; I36-Q40 HydrophobicContact CG2-CB 4.14Å; I36-Q41 HydrophobicContact CB-CG 4.41Å; I36-Q41 HydrophobicContact CG2-CG 3.83Å; I36-Q41 PolarHBondContact O-NE2 2.9Å; I36-L69 HydrophobicContact CD1-CD2 4.44Å; I36-L71 HydrophobicContact CD1-CD2 3.81Å; I36-L71 HydrophobicContact CG2-CD2 3.55Å
37P91Very high91.7Very high41 Ų4157.6 Ų57.627%0.26634%0.335SS..  trans-56.3139.7178.3-30.138.7000113.8G35 D39 Q40 Q41G35-P37 WeakPolarHBondContact O-CD 3.26Å; P37-D39 WeakPolarHBondContact CB-OD1 3.45Å; P37-D39 PolarHBondContact O-N 3.43Å; P37-Q40 HydrophobicContact CB-CG 4.31Å; P37-Q40 WeakPolarHBondContact O-CA 3.45Å; P37-Q40 WeakPolarHBondContact O-CB 3.15Å; P37-Q40 PolarHBondContact O-N 3.35Å; P37-Q41 PolarHBondContact O-N 3.45Å
38P90.9Very high91.6Very high39 Ų3964.6 Ų64.625%0.25337%0.365SS..G310 helixtrans-57.4-31.8-176.9-28.935.8000114.4K27 Q31 Q40 Q41K27-P38 HydrophobicContact CB-CB 3.99Å; K27-P38 HydrophobicContact CD-CB 4.4Å; Q31-P38 HydrophobicContact CB-CG 4.49Å; P38-Q40 PolarHBondContact O-N 3.05Å; P38-Q41 PolarHBondContact O-N 2.75Å; P38-Q41 VanDerWaalsContact O-N 3.14Å
39D88.7Confident91.6Very high97 Ų9767.5 Ų67.552%0.51937%0.372SS..G310 helixtrans-67.9-19.4175.572.3-48.7000112.5P37 R72P37-D39 WeakPolarHBondContact CB-OD1 3.45Å; P37-D39 PolarHBondContact O-N 3.43Å; D39-R72 WeakPolarHBondContact O-CD 3.32Å; D39-R72 VanDerWaalsContact O-CZ 3.23Å; D39-R72 PolarHBondContact O-NE 3.25Å; D39-R72 PolarHBondContact O-NH1 3.07Å
40Q89.2Confident91.6Very high92 Ų9264.4 Ų64.443%0.4336%0.359SS..G310 helixtrans-95-7.4175-61.1179.912.300112.5I36 P37 P38 L71 R72I36-Q40 HydrophobicContact CG2-CB 4.14Å; P37-Q40 HydrophobicContact CB-CG 4.31Å; P37-Q40 WeakPolarHBondContact O-CA 3.45Å; P37-Q40 WeakPolarHBondContact O-CB 3.15Å; P37-Q40 PolarHBondContact O-N 3.35Å; P38-Q40 PolarHBondContact O-N 3.05Å; Q40-L71 CarbonylContact O-C 3.59Å; Q40-L71 WeakPolarHBondContact O-CA 3.42Å; Q40-R72 PolarHBondContact O-N 2.85Å
41Q92.2Very high91.6Very high0 Ų069.5 Ų69.50%038%0.383CS..EExtended strand (participates in β ladder)trans-91.3136.5-178.3-60179.330.200112.2K27 I36 P37 P38 L69K27-Q41 VanDerWaalsContact CA-OE1 3.31Å; K27-Q41 HydrophobicContact CD-CB 4.28Å; K27-Q41 HydrophobicContact CG-CB 4.27Å; K27-Q41 PolarHBondContact NZ-O 3.49Å; K27-Q41 PolarHBondContact O-NE2 3.38Å; K27-Q41 PolarHBondContact O-OE1 3.2Å; I36-Q41 HydrophobicContact CB-CG 4.41Å; I36-Q41 HydrophobicContact CG2-CG 3.83Å; I36-Q41 PolarHBondContact O-NE2 2.9Å; P37-Q41 PolarHBondContact O-N 3.45Å; P38-Q41 PolarHBondContact O-N 2.75Å; P38-Q41 VanDerWaalsContact O-N 3.14Å; Q41-L69 HydrophobicContact CB-CD1 3.82Å; Q41-L69 HydrophobicContact CG-CD1 3.98Å
42R92.3Very high91.5Very high97 Ų9768.6 Ų68.637%0.36638%0.381SS..EExtended strand (participates in β ladder)trans-121.2118.2162.4-61.2-175.4175.1177.50.3108.5V70 R72R42-V70 WeakPolarHBondContact CA-O 3.39Å; R42-V70 HydrophobicContact CB-CB 4.31Å; R42-V70 WeakPolarHBondContact CB-O 3.32Å; R42-V70 PolarHBondContact N-O 2.95Å; R42-V70 PolarHBondContact O-N 3.2Å; R42-R72 HydrophobicContact CG-CG 3.68Å
43L94Very high91.5Very high0 Ų065.8 Ų65.80%038%0.384CS..EExtended strand (participates in β ladder)trans-96132.9172.4-63.4176.8000109.1V5 I23 V26 K27 I30 Q49 L50 H68 L69V5-L43 HydrophobicContact CG1-CD2 4.31Å; I23-L43 HydrophobicContact CG2-CD1 4.22Å; V26-L43 HydrophobicContact CB-CD1 4.47Å; V26-L43 HydrophobicContact CG1-CD1 3.97Å; K27-L43 HydrophobicContact CG-CD1 3.83Å; K27-L43 HydrophobicContact CG-CG 4.36Å; I30-L43 HydrophobicContact CD1-CD1 4.02Å; I30-L43 HydrophobicContact CD1-CD2 3.61Å; I30-L43 HydrophobicContact CD1-CG 4.36Å; L43-Q49 WeakPolarHBondContact O-CA 3.49Å; L43-L50 HydrophobicContact CB-CB 4.35Å; L43-L50 HydrophobicContact CB-CD1 4.02Å; L43-L50 HydrophobicContact CB-CG 4.33Å; L43-L50 PolarHBondContact O-N 2.72Å; L43-H68 WeakPolarHBondContact CA-O 3.34Å; L43-L69 HydrophobicContact CD2-CB 4.24Å; L43-L69 HydrophobicContact CD2-CD1 3.82Å
44I94.5Very high91.6Very high47 Ų4765.7 Ų65.724%0.24138%0.38CS..EExtended strand (participates in β ladder)trans-126.7130-178.3-56.5175.4000108.7K48 H68 V70I44-K48 WeakPolarHBondContact CA-O 3.29Å; I44-H68 HydrophobicContact CB-CB 4.27Å; I44-H68 PolarHBondContact N-O 3.03Å; I44-H68 PolarHBondContact O-N 3.26Å; I44-V70 HydrophobicContact CD1-CB 4.35Å; I44-V70 HydrophobicContact CD1-CG2 3.73Å
45F94.3Very high91.8Very high46 Ų4664.3 Ų64.320%0.20238%0.376CS..EExtended strand (participates in β ladder)trans-133.8135.4173.5-172.5-121.3000109.5G47 K48 L50 I61 L67F45-G47 PolarHBondContact O-N 3.02Å; F45-G47 VanDerWaalsContact O-N 3.07Å; F45-K48 PolarHBondContact N-O 2.92Å; F45-K48 PolarHBondContact O-N 2.81Å; F45-L50 HydrophobicContact CB-CD1 4.35Å; F45-L50 HydrophobicContact CB-CD2 4.01Å; F45-L50 HydrophobicContact CB-CG 4.45Å; F45-I61 HydrophobicContact CD1-CD1 4.36Å; F45-I61 HydrophobicContact CD1-CG1 3.78Å; F45-I61 HydrophobicContact CE1-CG1 3.84Å; F45-I61 HydrophobicContact CG-CG1 4.26Å; F45-I61 HydrophobicContact CZ-CG1 4.37Å; F45-L67 HydrophobicContact CB-CD2 3.55Å; F45-L67 HydrophobicContact CD2-CD2 3.68Å; F45-L67 HydrophobicContact CG-CD2 3.8Å
46A91.6Very high92Very high88 Ų8861.6 Ų61.673%0.72735%0.348SS*.THydrogen-bonded Turntrans48.537.8-179.300000113.9K48A46-K48 PolarHBondContact O-N 2.76Å
47G90.6Very high92.1Very high75 Ų7562.8 Ų62.877%0.77336%0.359SS*.THydrogen-bonded Turntrans74.40.1-177.900000115.6F45F45-G47 PolarHBondContact O-N 3.02Å; F45-G47 VanDerWaalsContact O-N 3.07Å
48K92.1Very high92.2Very high148 Ų14865.4 Ų65.464%0.64337%0.371SS*.EExtended strand (participates in β ladder)trans-103.6135.9177.8-65.7-178.2-180178.20110.9I44 F45 A46I44-K48 WeakPolarHBondContact CA-O 3.29Å; F45-K48 PolarHBondContact N-O 2.92Å; F45-K48 PolarHBondContact O-N 2.81Å; A46-K48 PolarHBondContact O-N 2.76Å
49Q92.4Very high92.2Very high100 Ų10065.3 Ų65.347%0.46737%0.366SS..EExtended strand (participates in β ladder)trans-73.6133.4169.6-175.2-177.5-36.500109.2L43L43-Q49 WeakPolarHBondContact O-CA 3.49Å
50L93.8Very high92.4Very high3 Ų367 Ų672%0.01638%0.375CS..PPolyproline II helixtrans-81.5137.3178.7-53.5-175.9000110.9I23 L43 F45 Y59 I61 L67I23-L50 HydrophobicContact CD1-CB 4.06Å; I23-L50 HydrophobicContact CD1-CD1 3.61Å; I23-L50 HydrophobicContact CD1-CG 4.38Å; I23-L50 HydrophobicContact CG1-CB 3.96Å; I23-L50 HydrophobicContact CG1-CD1 4.44Å; I23-L50 HydrophobicContact CG2-CB 3.84Å; L43-L50 HydrophobicContact CB-CB 4.35Å; L43-L50 HydrophobicContact CB-CD1 4.02Å; L43-L50 HydrophobicContact CB-CG 4.33Å; L43-L50 PolarHBondContact O-N 2.72Å; F45-L50 HydrophobicContact CB-CD1 4.35Å; F45-L50 HydrophobicContact CB-CD2 4.01Å; F45-L50 HydrophobicContact CB-CG 4.45Å; L50-Y59 HydrophobicContact CB-CE2 4.16Å; L50-Y59 HydrophobicContact CD2-CD1 3.66Å; L50-Y59 HydrophobicContact CD2-CD2 3.67Å; L50-Y59 HydrophobicContact CD2-CE1 3.69Å; L50-Y59 HydrophobicContact CD2-CE2 3.66Å; L50-Y59 HydrophobicContact CD2-CG 3.64Å; L50-Y59 HydrophobicContact CG-CE2 4.46Å; L50-I61 HydrophobicContact CD1-CD1 3.99Å; L50-L67 HydrophobicContact CD1-CD1 4.38Å; L50-L67 HydrophobicContact CD1-CD2 3.93Å
51E93.5Very high92.5Very high107 Ų10762.9 Ų62.950%0.536%0.356SS..PPolyproline II helixtrans-92.2141.5177.6-66.5177.3166.300110.8I23 G53 R54 Y59I23-E51 VanDerWaalsContact CB-O 3.29Å; I23-E51 WeakPolarHBondContact CB-O 2.99Å; I23-E51 WeakPolarHBondContact CG1-O 3.46Å; E51-G53 VanDerWaalsContact C-N 3.29Å; E51-G53 PolarHBondContact O-N 2.62Å; E51-R54 HydrophobicContact CB-CG 4.46Å; E51-R54 PolarHBondContact O-N 3.17Å; E51-R54 IonicContact OE2-CZ 2.62Å; E51-R54 VanDerWaalsContact OE2-CZ 3.31Å; E51-R54 IonicContact OE2-NE 3.05Å; E51-R54 PolarHBondContact OE2-NE 3.32Å; E51-R54 IonicContact OE2-NH2 3.49Å; E51-R54 PolarHBondContact OE2-NH2 2.86Å; E51-Y59 PolarHBondContact N-OH 2.7Å
52D91.6Very high92.5Very high60 Ų6069.6 Ų69.632%0.32139%0.387SS..THydrogen-bonded Turntrans-63.1-31.9-171.6-66.6-33.2000113.4E24 K27 R54E24-D52 HydrophobicContact CB-CB 4.33Å; E24-D52 PolarHBondContact N-O 3.05Å; K27-D52 WeakPolarHBondContact CD-OD1 3.42Å; K27-D52 WeakPolarHBondContact CE-OD1 3.47Å; K27-D52 IonicContact NZ-OD1 2.68Å; K27-D52 PolarHBondContact NZ-OD1 2.82Å; K27-D52 IonicContact NZ-OD2 3.2Å; K27-D52 PolarHBondContact NZ-OD2 3.49Å; D52-R54 PolarHBondContact O-N 2.62Å
53G90.9Very high92.4Very high77 Ų7771.1 Ų71.179%0.79440%0.396SS*.THydrogen-bonded Turntrans-86.75.6-177.600000116.3E51E51-G53 VanDerWaalsContact C-N 3.29Å; E51-G53 PolarHBondContact O-N 2.62Å
54R92.7Very high92.3Very high111 Ų11176.8 Ų76.842%0.41942%0.423SS..SBendtrans-103.9158.2176.2-65.8-169.5-160-152.50.2111.2T22 I23 E51 D52 D58 Y59T22-R54 CarbonylContact C-O 3.6Å; T22-R54 WeakPolarHBondContact CA-O 3.41Å; I23-R54 WeakPolarHBondContact CG1-O 3.46Å; I23-R54 PolarHBondContact N-O 3.27Å; E51-R54 HydrophobicContact CB-CG 4.46Å; E51-R54 PolarHBondContact O-N 3.17Å; E51-R54 IonicContact OE2-CZ 2.62Å; E51-R54 VanDerWaalsContact OE2-CZ 3.31Å; E51-R54 IonicContact OE2-NE 3.05Å; E51-R54 PolarHBondContact OE2-NE 3.32Å; E51-R54 IonicContact OE2-NH2 3.49Å; E51-R54 PolarHBondContact OE2-NH2 2.86Å; D52-R54 PolarHBondContact O-N 2.62Å; R54-D58 HydrophobicContact CB-CB 4.24Å; R54-Y59 HydrophobicContact CB-CD2 4.27Å; R54-Y59 HydrophobicContact CB-CE2 3.63Å; R54-Y59 WeakPolarHBondContact CD-OH 3.46Å; R54-Y59 HydrophobicContact CG-CE2 4.28Å
55T93.8Very high92.3Very high31 Ų3175.5 Ų75.519%0.1942%0.418CS..BIsolated β-bridgetrans-90.1164.7176.762.80000111.7D21 S57 D58D21-T55 WeakPolarHBondContact O-CA 3.03Å; T55-S57 PolarHBondContact O-N 3.14Å; T55-S57 PolarHBondContact OG1-OG 2.78Å; T55-D58 PolarHBondContact N-OD2 3.2Å; T55-D58 PolarHBondContact O-N 2.82Å; T55-D58 PolarHBondContact OG1-N 3.32Å; T55-D58 PolarHBondContact OG1-OD1 3.35Å; T55-D58 PolarHBondContact OG1-OD2 3.18Å
56L93.3Very high92.3Very high0 Ų076 Ų760%043%0.425CS..THydrogen-bonded Turntrans-61.5-34.5170.4-69.1178000112M1 V17 D21 I23 V26 D58 Y59 N60 I61M1-L56 HydrophobicContact CE-CB 3.91Å; M1-L56 HydrophobicContact CE-CD1 3.54Å; M1-L56 HydrophobicContact CE-CG 4.36Å; V17-L56 HydrophobicContact CB-CD1 3.72Å; V17-L56 HydrophobicContact CG1-CD1 4.34Å; V17-L56 HydrophobicContact CG2-CD1 3.5Å; D21-L56 HydrophobicContact CB-CD1 4.35Å; D21-L56 PolarHBondContact O-N 3.44Å; I23-L56 HydrophobicContact CD1-CD2 3.74Å; V26-L56 HydrophobicContact CG2-CD1 3.94Å; V26-L56 HydrophobicContact CG2-CD2 4.12Å; V26-L56 HydrophobicContact CG2-CG 4.17Å; L56-D58 PolarHBondContact O-N 2.91Å; L56-Y59 PolarHBondContact O-N 3.32Å; L56-N60 PolarHBondContact O-N 2.87Å; L56-I61 HydrophobicContact CB-CB 4.29Å; L56-I61 HydrophobicContact CD2-CB 4.21Å; L56-I61 HydrophobicContact CD2-CD1 3.45Å; L56-I61 VanDerWaalsContact CD2-CD1 3.45Å; L56-I61 HydrophobicContact CD2-CG1 4.42Å; L56-I61 HydrophobicContact CD2-CG2 4.18Å; L56-I61 PolarHBondContact O-N 3.18Å
57S91.4Very high92.4Very high59 Ų5971.8 Ų71.841%0.41339%0.39SS..G310 helixtrans-62-37.6173.938.20000113.4P19 T55 Y59 N60P19-S57 PolarHBondContact O-N 3.32Å; P19-S57 PolarHBondContact O-OG 2.85Å; P19-S57 VanDerWaalsContact O-OG 3.14Å; T55-S57 PolarHBondContact O-N 3.14Å; T55-S57 PolarHBondContact OG1-OG 2.78Å; S57-Y59 PolarHBondContact O-N 3.36Å; S57-N60 PolarHBondContact O-N 3.26Å
58D92.4Very high92.6Very high97 Ų9772.5 Ų72.552%0.51937%0.373SS..G310 helixtrans-63.6-25.7-179.2-63.2-37.3000112.8R54 T55 L56R54-D58 HydrophobicContact CB-CB 4.24Å; T55-D58 PolarHBondContact N-OD2 3.2Å; T55-D58 PolarHBondContact O-N 2.82Å; T55-D58 PolarHBondContact OG1-N 3.32Å; T55-D58 PolarHBondContact OG1-OD1 3.35Å; T55-D58 PolarHBondContact OG1-OD2 3.18Å; L56-D58 PolarHBondContact O-N 2.91Å
59Y92Very high92.7Very high37 Ų3765.8 Ų65.815%0.14534%0.344CS..G310 helixtrans-98.57.7176.8-70.7-73000113.4I23 L50 E51 R54 L56 S57 I61I23-Y59 HydrophobicContact CD1-CD2 4.44Å; I23-Y59 HydrophobicContact CG1-CE2 4.24Å; L50-Y59 HydrophobicContact CB-CE2 4.16Å; L50-Y59 HydrophobicContact CD2-CD1 3.66Å; L50-Y59 HydrophobicContact CD2-CD2 3.67Å; L50-Y59 HydrophobicContact CD2-CE1 3.69Å; L50-Y59 HydrophobicContact CD2-CE2 3.66Å; L50-Y59 HydrophobicContact CD2-CG 3.64Å; L50-Y59 HydrophobicContact CG-CE2 4.46Å; E51-Y59 PolarHBondContact N-OH 2.7Å; R54-Y59 HydrophobicContact CB-CD2 4.27Å; R54-Y59 HydrophobicContact CB-CE2 3.63Å; R54-Y59 WeakPolarHBondContact CD-OH 3.46Å; R54-Y59 HydrophobicContact CG-CE2 4.28Å; L56-Y59 PolarHBondContact O-N 3.32Å; S57-Y59 PolarHBondContact O-N 3.36Å; Y59-I61 PolarHBondContact O-N 3.06Å
60N91.3Very high92.7Very high131 Ų13162.9 Ų62.970%0.70133%0.333SS*.THydrogen-bonded Turntrans51.737.7-174.5-65.1-41.5000112.7L56 S57 Q62L56-N60 PolarHBondContact O-N 2.87Å; S57-N60 PolarHBondContact O-N 3.26Å; N60-Q62 PolarHBondContact O-N 3.05Å
61I92.2Very high92.4Very high6 Ų666.7 Ų66.73%0.03135%0.353CS..  trans-76.5112.7177.9-65.2165.8000108I3 F45 L50 L56 Y59 L67I3-I61 HydrophobicContact CG2-CG2 4.04Å; F45-I61 HydrophobicContact CD1-CD1 4.36Å; F45-I61 HydrophobicContact CD1-CG1 3.78Å; F45-I61 HydrophobicContact CE1-CG1 3.84Å; F45-I61 HydrophobicContact CG-CG1 4.26Å; F45-I61 HydrophobicContact CZ-CG1 4.37Å; L50-I61 HydrophobicContact CD1-CD1 3.99Å; L56-I61 HydrophobicContact CB-CB 4.29Å; L56-I61 HydrophobicContact CD2-CB 4.21Å; L56-I61 HydrophobicContact CD2-CD1 3.45Å; L56-I61 VanDerWaalsContact CD2-CD1 3.45Å; L56-I61 HydrophobicContact CD2-CG1 4.42Å; L56-I61 HydrophobicContact CD2-CG2 4.18Å; L56-I61 PolarHBondContact O-N 3.18Å; Y59-I61 PolarHBondContact O-N 3.06Å; I61-L67 HydrophobicContact CD1-CD2 4.01Å
62Q91Very high91.9Very high141 Ų14166 Ų6666%0.65935%0.346SS*.  trans-95.5172.9-178.9-63.9-176.3-8.300111.7N60 E64 S65N60-Q62 PolarHBondContact O-N 3.05Å; Q62-E64 PolarHBondContact O-N 2.92Å; Q62-S65 PolarHBondContact N-OG 2.96Å; Q62-S65 VanDerWaalsContact O-CB 3.26Å; Q62-S65 WeakPolarHBondContact O-CB 3.49Å; Q62-S65 PolarHBondContact O-N 2.76Å; Q62-S65 VanDerWaalsContact O-N 3.17Å; Q62-S65 PolarHBondContact O-OG 2.87Å
63K91Very high91Very high130 Ų13070.8 Ų70.857%0.56537%0.371SS*.THydrogen-bonded Turntrans-52.2139.2168.4-173-177172.2-166.20109.6M1 S65M1-K63 HydrophobicContact CB-CB 4.36Å; K63-S65 PolarHBondContact O-N 3.26Å
64E91.5Very high90Very high119 Ų11978.9 Ų78.956%0.55638%0.377SS*.THydrogen-bonded Turntrans67.910.9-179.5-65.4156.1-149.800115.5Q2 F4 Q62Q2-E64 PolarHBondContact O-N 3.5Å; F4-E64 HydrophobicContact CE2-CB 3.98Å; F4-E64 HydrophobicContact CE2-CG 3.93Å; Q62-E64 PolarHBondContact O-N 2.92Å
65S94.4Very high88.5Confident19 Ų1976.9 Ų76.913%0.13339%0.391CS..  trans-63.8142171.7-61.30000112F4 Q62 K63F4-S65 PolarHBondContact N-O 2.8Å; Q62-S65 PolarHBondContact N-OG 2.96Å; Q62-S65 VanDerWaalsContact O-CB 3.26Å; Q62-S65 WeakPolarHBondContact O-CB 3.49Å; Q62-S65 PolarHBondContact O-N 2.76Å; Q62-S65 VanDerWaalsContact O-N 3.17Å; Q62-S65 PolarHBondContact O-OG 2.87Å; K63-S65 PolarHBondContact O-N 3.26Å
66T94.2Very high87Confident57 Ų5778.9 Ų78.935%0.3542%0.418SS..EExtended strand (participates in β ladder)trans-102.5115.8175.660.80000111.3F4F4-T66 HydrophobicContact CB-CG2 4.07Å; F4-T66 CarbonylContact O-C 3.53Å; F4-T66 VanDerWaalsContact O-CA 3.28Å; F4-T66 WeakPolarHBondContact O-CA 3.43Å
67L94.8Very high85.6Confident0 Ų083.6 Ų83.60%046%0.457CS..EExtended strand (participates in β ladder)trans-92.2146.7169.4-59.9-178.3000110.2I3 F4 V5 K6 F45 L50 I61I3-L67 HydrophobicContact CD1-CD1 3.8Å; F4-L67 PolarHBondContact O-N 2.8Å; V5-L67 CarbonylContact C-O 3.52Å; V5-L67 WeakPolarHBondContact CA-O 3.15Å; V5-L67 HydrophobicContact CG2-CB 4.31Å; K6-L67 PolarHBondContact N-O 2.86Å; F45-L67 HydrophobicContact CB-CD2 3.55Å; F45-L67 HydrophobicContact CD2-CD2 3.68Å; F45-L67 HydrophobicContact CG-CD2 3.8Å; L50-L67 HydrophobicContact CD1-CD1 4.38Å; L50-L67 HydrophobicContact CD1-CD2 3.93Å; I61-L67 HydrophobicContact CD1-CD2 4.01Å
68H95Very high84.4Confident90 Ų9090.8 Ų90.842%0.41748%0.481SS..EExtended strand (participates in β ladder)trans-100.9124.6171.3-66.9-77.1000110.4K6 L43 I44K6-H68 WeakPolarHBondContact O-CA 3.46Å; L43-H68 WeakPolarHBondContact CA-O 3.34Å; I44-H68 HydrophobicContact CB-CB 4.27Å; I44-H68 PolarHBondContact N-O 3.03Å; I44-H68 PolarHBondContact O-N 3.26Å
69L93.9Very high83.2Confident7 Ų795.7 Ų95.74%0.03750%0.498CS..EExtended strand (participates in β ladder)trans-95116.4173.3176.965.4000110V5 K6 T7 I30 I36 Q41 L43V5-L69 HydrophobicContact CG1-CB 3.55Å; V5-L69 HydrophobicContact CG1-CD2 4.47Å; K6-L69 PolarHBondContact O-N 2.89Å; T7-L69 HydrophobicContact CG2-CD2 4.31Å; I30-L69 HydrophobicContact CG2-CD2 3.87Å; I36-L69 HydrophobicContact CD1-CD2 4.44Å; Q41-L69 HydrophobicContact CB-CD1 3.82Å; Q41-L69 HydrophobicContact CG-CD1 3.98Å; L43-L69 HydrophobicContact CD2-CB 4.24Å; L43-L69 HydrophobicContact CD2-CD1 3.82Å
70V91.2Very high82.3Confident39 Ų39105.6 Ų105.624%0.23654%0.535CS..EExtended strand (participates in β ladder)trans-116.2136.4174.5-1800000108.2L8 R42 I44L8-V70 HydrophobicContact CD1-CG1 4.25Å; L8-V70 HydrophobicContact CD2-CG2 4.05Å; L8-V70 HydrophobicContact CG-CG2 4.44Å; R42-V70 WeakPolarHBondContact CA-O 3.39Å; R42-V70 HydrophobicContact CB-CB 4.31Å; R42-V70 WeakPolarHBondContact CB-O 3.32Å; R42-V70 PolarHBondContact N-O 2.95Å; R42-V70 PolarHBondContact O-N 3.2Å; I44-V70 HydrophobicContact CD1-CB 4.35Å; I44-V70 HydrophobicContact CD1-CG2 3.73Å
71L89.3Confident81.6Confident82 Ų82109 Ų10943%0.42954%0.543SS..EExtended strand (participates in β ladder)trans-78.9138.9176-61.1171.4000110.6I36 Q40 L73I36-L71 HydrophobicContact CD1-CD2 3.81Å; I36-L71 HydrophobicContact CG2-CD2 3.55Å; Q40-L71 CarbonylContact O-C 3.59Å; Q40-L71 WeakPolarHBondContact O-CA 3.42Å; L71-L73 PolarHBondContact O-N 3Å; L71-L73 VanDerWaalsContact O-N 3.12Å
72R82.2Confident81Confident93 Ų93118.8 Ų118.835%0.35159%0.585SS.*PPolyproline II helixtrans-60117.7167.3-65.9-153.3-176.3145.1-11.5107D39 Q40 R42 R74D39-R72 WeakPolarHBondContact O-CD 3.32Å; D39-R72 VanDerWaalsContact O-CZ 3.23Å; D39-R72 PolarHBondContact O-NE 3.25Å; D39-R72 PolarHBondContact O-NH1 3.07Å; Q40-R72 PolarHBondContact O-N 2.85Å; R42-R72 HydrophobicContact CG-CG 3.68Å; R72-R74 PolarHBondContact O-N 3.17Å
73L73.4Confident80.7Confident160 Ų160120.1 Ų120.184%0.83859%0.589SS**PPolyproline II helixtrans-59.8122.4171.5-62.4175.8000108.1L71 G75L71-L73 PolarHBondContact O-N 3Å; L71-L73 VanDerWaalsContact O-N 3.12Å; L73-G75 PolarHBondContact O-N 3.12Å
74R68.9Low80.5Confident247 Ų247119.1 Ų119.193%0.93260%0.598SS**  trans-56.8113173-164.1175.4-163.2171.65.5107.2R72 G76R72-R74 PolarHBondContact O-N 3.17Å; R74-G76 PolarHBondContact O-N 3.49Å
75G62Low80.2Confident69 Ų69122.2 Ų122.271%0.71161%0.606SS**  trans-48.9131-178.900000110.6L73 A77L73-G75 PolarHBondContact O-N 3.12Å; G75-A77 PolarHBondContact O-N 3.31Å
76G61.7Low80Confident74 Ų74127.5 Ų127.576%0.76364%0.638SS**  trans-47.7136.4-169.700000113R74R74-G76 PolarHBondContact O-N 3.49Å
77A63.2Low79.9Confident98 Ų98129.9 Ų129.981%0.8165%0.652SS**SBendtrans-37.6137.1-177.200000112.7G75 K79G75-A77 PolarHBondContact O-N 3.31Å; A77-K79 PolarHBondContact O-N 3.12Å
78K66.7Low79.7Confident210 Ų210135.4 Ų135.491%0.91369%0.689SS**  trans-32112.6-178.8-72.8179.3178.5174.30110.6R80K78-R80 PolarHBondContact O-N 3.03Å
79K68.6Low79.5Confident201 Ų201140.8 Ų140.887%0.87471%0.711SS**PPolyproline II helixtrans-48.7128.5179.6-69-176.2179.7177.80108.7A77 K81A77-K79 PolarHBondContact O-N 3.12Å; K79-K81 PolarHBondContact O-N 3.22Å; K79-K81 VanDerWaalsContact O-N 3.12Å
80R71.1Confident79.5Confident245 Ų245149.6 Ų149.693%0.92575%0.749SS**PPolyproline II helixtrans-52.8123.2175.3-79.9-175.3173.8176.2-1.4108.3K78 K82K78-R80 PolarHBondContact O-N 3.03Å; R80-K82 PolarHBondContact O-N 3.41Å
81K77.1Confident79.6Confident203 Ų203155.7 Ų155.788%0.88378%0.78SS**PPolyproline II helixtrans-56.6138.9173.7-68.3-174.8178.3-177.60108.5K79 K83K79-K81 PolarHBondContact O-N 3.22Å; K79-K81 VanDerWaalsContact O-N 3.12Å; K81-K83 PolarHBondContact O-N 3.47Å
82K80.7Confident79.8Confident210 Ų210160.9 Ų160.991%0.91380%0.799SS**PPolyproline II helixtrans-57.1135.5173.7-70.1-176.8178179.50108.5R80 S84R80-K82 PolarHBondContact O-N 3.41Å; K82-S84 PolarHBondContact O-N 3.35Å
83K83.6Confident80.5Confident170 Ų170164.2 Ų164.274%0.73982%0.818SS**PPolyproline II helixtrans-64.4126.5175.9-65.9-178.7179.5-179.40108.6K81 Y85K81-K83 PolarHBondContact O-N 3.47Å; K83-Y85 HydrophobicContact CB-CE1 4.37Å; K83-Y85 HydrophobicContact CB-CE2 4.25Å; K83-Y85 HydrophobicContact CD-CE1 4.44Å
84S87Confident81.5Confident108 Ų108165.2 Ų165.276%0.75582%0.816SS**PPolyproline II helixtrans-100.1121.4168.1-1760000108.2K82K82-S84 PolarHBondContact O-N 3.35Å
85Y85.9Confident82.7Confident184 Ų184164.2 Ų164.272%0.72281%0.812SS**  trans-97.1114.5178.1-56.5-77.7000108.7K83K83-Y85 HydrophobicContact CB-CE1 4.37Å; K83-Y85 HydrophobicContact CB-CE2 4.25Å; K83-Y85 HydrophobicContact CD-CE1 4.44Å
86T90.6Very high84.1Confident131 Ų131170.5 Ų170.580%0.80482%0.82SS**  trans-89.9-23.6179.951.50000112.9
87T91.2Very high85.6Confident106 Ų106176.6 Ų176.665%0.6583%0.825SS**SBendtrans-114.1138.7-177.558.90000111.2
88P90.6Very high87Confident117 Ų117176.1 Ų176.176%0.7681%0.812SS**PPolyproline II helixtrans-63.5147.517527.8-34.4000110.9K90P88-K90 PolarHBondContact O-N 3.32Å
89K91.8Very high88.4Confident202 Ų202175.6 Ų175.688%0.87881%0.81SS**PPolyproline II helixtrans-67.4122.8178.2-173.7176-178.6179.10110
90K93.7Very high89.5Confident193 Ų193172.4 Ų172.484%0.83980%0.802SS**PPolyproline II helixtrans-74.6135.2177.8-64.1-176.6-179.8-179.20111.4P88P88-K90 PolarHBondContact O-N 3.32Å
91N91.9Very high90.5Very high166 Ų166162.4 Ų162.489%0.88877%0.772SS**PPolyproline II helixtrans-70133.8171.3-75-27.3000110.3
92K95.1Very high91Very high192 Ų192157.2 Ų157.284%0.83576%0.756SS**PPolyproline II helixtrans-74.5141176.7-66.1-173.6177.9-175.60110.4K94K92-K94 PolarHBondContact O-N 2.99Å
93H95.7Very high91.5Very high163 Ų163152.9 Ų152.976%0.75574%0.743SS**PPolyproline II helixtrans-60.1131.9172.7172.8-98.9000110.7
94K94.8Very high91.7Very high181 Ų181151.5 Ų151.579%0.78774%0.737SS**  trans-110.6127.6172.7-66.7-178.2179.2179.90108.7K92 K96K92-K94 PolarHBondContact O-N 2.99Å; K94-K96 PolarHBondContact O-N 3.19Å
95R92.9Very high91.9Very high226 Ų226148.9 Ų148.985%0.85371%0.711SS**PPolyproline II helixtrans-61.1124.6176.3-75.3-176.2174.8147.1-1.8110K97R95-K97 PolarHBondContact O-N 3.25Å
96K92.9Very high92.2Very high200 Ų200144.1 Ų144.187%0.8769%0.692SS**PPolyproline II helixtrans-75.1119.4172.7-64.3-176.4-179.7-179.80109K94K94-K96 PolarHBondContact O-N 3.19Å
97K92.6Very high92.3Very high203 Ų203143.6 Ų143.688%0.88368%0.679SS**PPolyproline II helixtrans-98.1117.9172.5-68.2-174.7177.9-176.50108.8R95R95-K97 PolarHBondContact O-N 3.25Å
98V93.3Very high92.4Very high88 Ų88143.2 Ų143.253%0.53368%0.676SS.*PPolyproline II helixtrans-100.5119.9172.8179.80000107.4L100 A101V98-L100 PolarHBondContact O-N 3.42Å; V98-A101 HydrophobicContact CB-CB 4.23Å; V98-A101 HydrophobicContact CG1-CB 4.39Å
99K94.9Very high92.5Very high198 Ų198140.3 Ų140.386%0.86165%0.654SS**THydrogen-bonded Turntrans-59.9134.5177.2-66.6-175.8179-178.40109A101K99-A101 VanDerWaalsContact C-N 3.27Å; K99-A101 PolarHBondContact O-N 3.41Å
100L92Very high92.5Very high135 Ų135140.4 Ų140.471%0.70766%0.657SS**THydrogen-bonded Turntrans54.835.9175.7-55.8171.8000114.6V98 V102 L103V98-L100 PolarHBondContact O-N 3.42Å; L100-V102 PolarHBondContact O-N 3.02Å; L100-L103 HydrophobicContact CB-CD1 3.92Å; L100-L103 HydrophobicContact CB-CG 4.3Å; L100-L103 HydrophobicContact CD1-CD1 4.17Å; L100-L103 HydrophobicContact CG-CD1 4.49Å; L100-L103 PolarHBondContact O-N 3.47Å; L100-L103 VanDerWaalsContact O-N 3.13Å
101A91.6Very high92.6Very high35 Ų35137.9 Ų137.929%0.28965%0.653SS.*G310 helixtrans-55.8-26.9-178.200000114.6V98 K99 L103 K104V98-A101 HydrophobicContact CB-CB 4.23Å; V98-A101 HydrophobicContact CG1-CB 4.39Å; K99-A101 VanDerWaalsContact C-N 3.27Å; K99-A101 PolarHBondContact O-N 3.41Å; A101-L103 VanDerWaalsContact C-N 3.29Å; A101-L103 PolarHBondContact O-N 3.1Å; A101-K104 WeakPolarHBondContact O-CB 3.3Å; A101-K104 PolarHBondContact O-N 3.4Å
102V88.5Confident92.6Very high93 Ų93132.4 Ų132.456%0.56464%0.636SS**G310 helixtrans-64.3-31.9-179.6-179.20000112.3L100 K104 Y105 Y106L100-V102 PolarHBondContact O-N 3.02Å; V102-K104 PolarHBondContact O-N 3.16Å; V102-K104 VanDerWaalsContact O-N 3.16Å; V102-Y105 HydrophobicContact CG1-CD2 4.45Å; V102-Y105 WeakPolarHBondContact O-CB 3.46Å; V102-Y105 PolarHBondContact O-N 3.29Å; V102-Y105 VanDerWaalsContact O-N 3.07Å; V102-Y106 HydrophobicContact CG1-CE2 4.17Å
103L90.1Very high92.5Very high119 Ų119129.9 Ų129.962%0.62363%0.625SS**G310 helixtrans-64.6-21.4179.8-62.1179.6000112.5L100 A101 Y105 Y106L100-L103 HydrophobicContact CB-CD1 3.92Å; L100-L103 HydrophobicContact CB-CG 4.3Å; L100-L103 HydrophobicContact CD1-CD1 4.17Å; L100-L103 HydrophobicContact CG-CD1 4.49Å; L100-L103 PolarHBondContact O-N 3.47Å; L100-L103 VanDerWaalsContact O-N 3.13Å; A101-L103 VanDerWaalsContact C-N 3.29Å; A101-L103 PolarHBondContact O-N 3.1Å; L103-Y105 PolarHBondContact O-N 3.06Å; L103-Y105 VanDerWaalsContact O-N 3.16Å; L103-Y106 PolarHBondContact O-N 3.44Å
104K88.7Confident92.2Very high141 Ų141127.6 Ų127.661%0.61362%0.617SS**G310 helixtrans-67.7-10.5175.4-63.7-171.5174.8-169.70113.6A101 V102A101-K104 WeakPolarHBondContact O-CB 3.3Å; A101-K104 PolarHBondContact O-N 3.4Å; V102-K104 PolarHBondContact O-N 3.16Å; V102-K104 VanDerWaalsContact O-N 3.16Å
105Y91.3Very high92.1Very high54 Ų54123.1 Ų123.121%0.21260%0.599CS.*G310 helixtrans-96.7-8.6-175.9-51.6-28.4000113.1V102 L103 R116 L117 R118 F131V102-Y105 HydrophobicContact CG1-CD2 4.45Å; V102-Y105 WeakPolarHBondContact O-CB 3.46Å; V102-Y105 PolarHBondContact O-N 3.29Å; V102-Y105 VanDerWaalsContact O-N 3.07Å; L103-Y105 PolarHBondContact O-N 3.06Å; L103-Y105 VanDerWaalsContact O-N 3.16Å; Y105-R116 CarbonylContact O-C 3.52Å; Y105-R116 WeakPolarHBondContact O-CA 3.18Å; Y105-L117 PolarHBondContact O-N 2.8Å; Y105-R118 VanDerWaalsContact CD1-CD 3.44Å; Y105-R118 HydrophobicContact CD1-CG 3.98Å; Y105-R118 PolarHBondContact OH-NH1 2.79Å; Y105-F131 HydrophobicContact CD2-CB 4.47Å; Y105-F131 AromaticContact CD2-CD2 3.52Å; Y105-F131 HydrophobicContact CD2-CD2 3.52Å; Y105-F131 HydrophobicContact CD2-CE2 4.08Å; Y105-F131 HydrophobicContact CD2-CG 4.19Å; Y105-F131 HydrophobicContact CE2-CD2 4.25Å; Y105-F131 AromaticContact CG-CD2 3.94Å; Y105-F131 HydrophobicContact CG-CD2 3.94Å; Y105-F131 HydrophobicContact CG-CE2 4.4Å; Y105-F131 HydrophobicContact CG-CG 4.28Å
106Y92.2Very high91.9Very high84 Ų84119.3 Ų119.333%0.32959%0.585SS.*EExtended strand (participates in β ladder)trans-128.2143.7-176.1-59.4-81.2000110.3V102 L103 I114 H115 R116 F131V102-Y106 HydrophobicContact CG1-CE2 4.17Å; L103-Y106 PolarHBondContact O-N 3.44Å; Y106-I114 HydrophobicContact CD1-CG2 3.62Å; Y106-I114 HydrophobicContact CE1-CG2 4.42Å; Y106-I114 HydrophobicContact CG-CG2 4.29Å; Y106-H115 CarbonylContact C-O 3.54Å; Y106-H115 VanDerWaalsContact CA-O 3.3Å; Y106-H115 WeakPolarHBondContact CA-O 3.45Å; Y106-R116 HydrophobicContact CD1-CG 4.1Å; Y106-R116 HydrophobicContact CE1-CG 3.89Å; Y106-F131 HydrophobicContact CE1-CE2 4.35Å; Y106-F131 AromaticContact CE1-CZ 3.81Å; Y106-F131 HydrophobicContact CE1-CZ 3.81Å; Y106-F131 AromaticContact CE2-CE2 3.98Å; Y106-F131 HydrophobicContact CE2-CE2 3.98Å; Y106-F131 HydrophobicContact CE2-CZ 4.24Å; Y106-F131 AromaticContact CZ-CE2 3.62Å; Y106-F131 AromaticContact CZ-CZ 3.54Å; Y106-F131 VanDerWaalsContact OH-CE2 3.28Å; Y106-F131 WeakPolarHBondContact OH-CE2 3.34Å; Y106-F131 WeakPolarHBondContact OH-CZ 3.25Å
107K92.5Very high91.9Very high120 Ų120114.8 Ų114.852%0.52257%0.569SS.*EExtended strand (participates in β ladder)trans-121.1130.8166.1-179.3-179.4175.3-1710107.3H115 L117K107-H115 HydrophobicContact CB-CB 4.33Å; K107-H115 PolarHBondContact N-O 3.29Å; K107-H115 PolarHBondContact O-N 2.74Å; K107-L117 HydrophobicContact CB-CD1 4.19Å; K107-L117 HydrophobicContact CB-CD2 4.03Å; K107-L117 HydrophobicContact CB-CG 4.17Å
108V92.7Very high91.8Very high98 Ų98109 Ų10959%0.59454%0.542SS*.EExtended strand (participates in β ladder)trans-104.3124.9175.5-1740000107.1K113 I114V108-K113 WeakPolarHBondContact CA-O 3.21Å; V108-I114 HydrophobicContact CG2-CG1 4.43Å
109D92.4Very high91.7Very high56 Ų56110.7 Ų110.730%0.29954%0.539SS..  trans-83.2165.9174.9-74.4-6000110.9N111 G112 K113 H115D109-N111 PolarHBondContact O-N 2.84Å; D109-N111 VanDerWaalsContact O-N 3.12Å; D109-G112 PolarHBondContact O-N 2.86Å; D109-K113 PolarHBondContact N-O 2.78Å; D109-H115 IonicContact OD1-CD2 3.31Å; D109-H115 IonicContact OD2-CD2 2.86Å; D109-H115 PolarHBondContact OD2-CD2 3.47Å; D109-H115 IonicContact OD2-NE2 2.62Å; D109-H115 PolarHBondContact OD2-NE2 3.37Å
110E93.4Very high91.5Very high203 Ų203103.6 Ų103.695%0.94951%0.509SS*.THydrogen-bonded Turntrans-57.2-28.8-179.7-64.2175.8179.400113.1G112E110-G112 PolarHBondContact O-N 2.81Å
111N94.3Very high91.6Very high141 Ų14197.6 Ų97.675%0.75448%0.478SS*.THydrogen-bonded Turntrans-80.34.1176.7-64.1-38.2000114D109 K113D109-N111 PolarHBondContact O-N 2.84Å; D109-N111 VanDerWaalsContact O-N 3.12Å; N111-K113 VanDerWaalsContact C-N 3.27Å; N111-K113 PolarHBondContact O-N 3.24Å
112G91.8Very high91.6Very high51 Ų5199.3 Ų99.353%0.52649%0.486SS..SBendtrans76.37-175.900000114.9D109 E110D109-G112 PolarHBondContact O-N 2.86Å; E110-G112 PolarHBondContact O-N 2.81Å
113K93.3Very high91.7Very high138 Ų13896.3 Ų96.360%0.647%0.471SS*.PPolyproline II helixtrans-73.8136.6173.9-68.3-176.5-179.6177.50110.3V108 D109 N111V108-K113 WeakPolarHBondContact CA-O 3.21Å; D109-K113 PolarHBondContact N-O 2.78Å; N111-K113 VanDerWaalsContact C-N 3.27Å; N111-K113 PolarHBondContact O-N 3.24Å
114I90.9Very high91.7Very high115 Ų11598.8 Ų98.859%0.5949%0.485SS*.EExtended strand (participates in β ladder)trans-102.7118-178.2-55.6175.8000109.7Y106 V108Y106-I114 HydrophobicContact CD1-CG2 3.62Å; Y106-I114 HydrophobicContact CE1-CG2 4.42Å; Y106-I114 HydrophobicContact CG-CG2 4.29Å; V108-I114 HydrophobicContact CG2-CG1 4.43Å
115H90.8Very high91.7Very high88 Ų8899.6 Ų99.641%0.40749%0.491SS..EExtended strand (participates in β ladder)trans-98.8129.7173.1-69.6-77.6000111.1Y106 K107 D109Y106-H115 CarbonylContact C-O 3.54Å; Y106-H115 VanDerWaalsContact CA-O 3.3Å; Y106-H115 WeakPolarHBondContact CA-O 3.45Å; K107-H115 HydrophobicContact CB-CB 4.33Å; K107-H115 PolarHBondContact N-O 3.29Å; K107-H115 PolarHBondContact O-N 2.74Å; D109-H115 IonicContact OD1-CD2 3.31Å; D109-H115 IonicContact OD2-CD2 2.86Å; D109-H115 PolarHBondContact OD2-CD2 3.47Å; D109-H115 IonicContact OD2-NE2 2.62Å; D109-H115 PolarHBondContact OD2-NE2 3.37Å
116R90.7Very high91.4Very high146 Ų14697 Ų9755%0.55148%0.481SS*.EExtended strand (participates in β ladder)trans-84.9121173.7-62.7178.6-170.7162.97.2109.2Y105 Y106 E120 F131Y105-R116 CarbonylContact O-C 3.52Å; Y105-R116 WeakPolarHBondContact O-CA 3.18Å; Y106-R116 HydrophobicContact CD1-CG 4.1Å; Y106-R116 HydrophobicContact CE1-CG 3.89Å; R116-E120 VanDerWaalsContact CD-OE1 3.3Å; R116-E120 WeakPolarHBondContact CD-OE1 3.46Å; R116-E120 IonicContact CZ-OE1 2.97Å; R116-E120 IonicContact NE-OE1 3.67Å; R116-E120 PolarHBondContact NE-OE1 3.21Å; R116-E120 IonicContact NH1-OE1 3.18Å; R116-E120 PolarHBondContact NH1-OE1 2.84Å; R116-E120 IonicContact NH1-OE2 3.4Å; R116-E120 PolarHBondContact NH1-OE2 2.8Å; R116-F131 HydrophobicContact CB-CE1 4.14Å; R116-F131 HydrophobicContact CG-CE1 4.24Å; R116-F131 HydrophobicContact CG-CZ 4.33Å
117L91.3Very high90.7Very high105 Ų10595 Ų9555%0.5549%0.485SS..  trans-87.3-7.7-178.1-63.2177.5000113.5Y105 K107Y105-L117 PolarHBondContact O-N 2.8Å; K107-L117 HydrophobicContact CB-CD1 4.19Å; K107-L117 HydrophobicContact CB-CD2 4.03Å; K107-L117 HydrophobicContact CB-CG 4.17Å
118R91.1Very high90.3Very high81 Ų8193.4 Ų93.431%0.30650%0.495SS..SBendtrans-126.3150.5178.5-72.2-163.2174.7-176.7-2.5111.4Y105 F131 M132Y105-R118 VanDerWaalsContact CD1-CD 3.44Å; Y105-R118 HydrophobicContact CD1-CG 3.98Å; Y105-R118 PolarHBondContact OH-NH1 2.79Å; R118-F131 HydrophobicContact CB-CB 3.94Å; R118-F131 HydrophobicContact CB-CD1 3.7Å; R118-F131 HydrophobicContact CB-CG 4.08Å; R118-F131 WeakPolarHBondContact O-CD1 3.47Å; R118-M132 WeakPolarHBondContact CD-O 3.21Å
119R90.4Very high90Very high123 Ų12390.6 Ų90.646%0.46449%0.485SS..PPolyproline II helixtrans-67.6135.4173.8-172.3175-175.5178.91.2110.5F131 M132R119-F131 WeakPolarHBondContact O-CA 3.31Å; R119-M132 HydrophobicContact CG-SD 4.39Å; R119-M132 PolarHBondContact O-N 3.34Å
120E92.5Very high90Very high50 Ų5089.6 Ų89.623%0.23448%0.481CS..BIsolated β-bridgetrans-81.5148.9171.1-67-175.9163.400111R116 G129 V130 F131R116-E120 VanDerWaalsContact CD-OE1 3.3Å; R116-E120 WeakPolarHBondContact CD-OE1 3.46Å; R116-E120 IonicContact CZ-OE1 2.97Å; R116-E120 IonicContact NE-OE1 3.67Å; R116-E120 PolarHBondContact NE-OE1 3.21Å; R116-E120 IonicContact NH1-OE1 3.18Å; R116-E120 PolarHBondContact NH1-OE1 2.84Å; R116-E120 IonicContact NH1-OE2 3.4Å; R116-E120 PolarHBondContact NH1-OE2 2.8Å; E120-G129 PolarHBondContact OE1-N 3.14Å; E120-V130 WeakPolarHBondContact CA-O 3.47Å; E120-F131 HydrophobicContact CG-CD1 3.99Å; E120-F131 HydrophobicContact CG-CE1 3.82Å
121C93Very high90Very high8 Ų881.2 Ų81.25%0.05444%0.442CS..PPolyproline II helixtrans-69.9131174.9-169.20000109.7A123 C126 V130 M132 C141 C144C121-A123 VanDerWaalsContact C-N 3.33Å; C121-C126 HydrophobicContact CB-CB 3.61Å; C121-C126 VanDerWaalsContact SG-CB 3.57Å; C121-V130 HydrophobicContact CB-CB 4.47Å; C121-V130 HydrophobicContact CB-CG1 4.22Å; C121-V130 PolarHBondContact N-O 3.27Å; C121-M132 HydrophobicContact CB-CG 4.19Å; C121-C141 HydrophobicContact CB-CB 4.31Å; C121-C144 PolarHBondContact SG-SG 3.43Å
122P91.7Very high90Very high71 Ų7174.5 Ų74.546%0.46141%0.406SS..  trans-84.9-2.9178.333-35.7000113.9L146 Y148P122-L146 HydrophobicContact CG-CD2 3.84Å; P122-Y148 HydrophobicContact CG-CE2 3.87Å; P122-Y148 VanDerWaalsContact CG-OH 3.31Å; P122-Y148 WeakPolarHBondContact CG-OH 3.46Å
123A91.3Very high90.1Very high31 Ų3173.4 Ų73.426%0.25639%0.392SS..SBendtrans-71138.1-179.100000110.5C121 E125 C126C121-A123 VanDerWaalsContact C-N 3.33Å; A123-E125 PolarHBondContact O-N 3.45Å; A123-E125 VanDerWaalsContact O-N 3.16Å; A123-C126 HydrophobicContact CB-CB 4.25Å; A123-C126 CarbonylContact O-C 3.59Å; A123-C126 WeakPolarHBondContact O-CA 3.3Å; A123-C126 PolarHBondContact O-N 3.38Å; A123-C126 VanDerWaalsContact O-O 3.14Å
124D89.2Confident90.1Very high170 Ų17070.1 Ų70.191%0.90939%0.386SS*.THydrogen-bonded Turntrans-58.2-33.5-176.8-60.8-42.3000112.9C126D124-C126 PolarHBondContact O-N 3.44Å
125E89.7Confident90.2Very high158 Ų15868.5 Ų68.574%0.73838%0.376SS*.THydrogen-bonded Turntrans-71.4-18.6175-58.9-175.8169.600113.6A123 K143A123-E125 PolarHBondContact O-N 3.45Å; A123-E125 VanDerWaalsContact O-N 3.16Å; E125-K143 PolarHBondContact O-NZ 2.89Å
126C83.6Confident90.2Very high0 Ų072.6 Ų72.60%039%0.393CS..SBendtrans-117.170.8-177.2-63.60000109.8C121 A123 D124 V130 C144C121-C126 HydrophobicContact CB-CB 3.61Å; C121-C126 VanDerWaalsContact SG-CB 3.57Å; A123-C126 HydrophobicContact CB-CB 4.25Å; A123-C126 CarbonylContact O-C 3.59Å; A123-C126 WeakPolarHBondContact O-CA 3.3Å; A123-C126 PolarHBondContact O-N 3.38Å; A123-C126 VanDerWaalsContact O-O 3.14Å; D124-C126 PolarHBondContact O-N 3.44Å; C126-V130 HydrophobicContact CB-CB 4.23Å; C126-V130 HydrophobicContact CB-CG1 4.09Å; C126-V130 HydrophobicContact CB-CG2 4.4Å; C126-C144 VanDerWaalsContact SG-CB 3.51Å
127G77.6Confident90.3Very high41 Ų4166.9 Ų66.942%0.42337%0.373SS..  trans-67.9-168.6-17800000116G129 V130G127-G129 PolarHBondContact O-N 3.46Å; G127-V130 PolarHBondContact O-N 3.37Å; G127-V130 VanDerWaalsContact O-N 3.14Å
128A84.7Confident90.4Very high88 Ų8866.5 Ų66.573%0.72736%0.364SS*.THydrogen-bonded Turntrans-50.2134.4-17900000112.3
129G86.6Confident90.6Very high38 Ų3864.5 Ų64.539%0.39236%0.358SS..THydrogen-bonded Turntrans90.8-7.8-175.800000115.8E120 G127 F131E120-G129 PolarHBondContact OE1-N 3.14Å; G127-G129 PolarHBondContact O-N 3.46Å; G129-F131 WeakPolarHBondContact O-CD2 3.41Å; G129-F131 PolarHBondContact O-N 3.41Å
130V92.6Very high90.8Very high36 Ų3662.1 Ų62.122%0.21835%0.35CS..  trans-86.599.8169.8-176.60000110.1E120 C121 C126 G127 K143E120-V130 WeakPolarHBondContact CA-O 3.47Å; C121-V130 HydrophobicContact CB-CB 4.47Å; C121-V130 HydrophobicContact CB-CG1 4.22Å; C121-V130 PolarHBondContact N-O 3.27Å; C126-V130 HydrophobicContact CB-CB 4.23Å; C126-V130 HydrophobicContact CB-CG1 4.09Å; C126-V130 HydrophobicContact CB-CG2 4.4Å; G127-V130 PolarHBondContact O-N 3.37Å; G127-V130 VanDerWaalsContact O-N 3.14Å; V130-K143 HydrophobicContact CG1-CB 4.26Å; V130-K143 HydrophobicContact CG2-CD 4.36Å
131F93.6Very high90.9Very high26 Ų2659.7 Ų59.711%0.11434%0.339CS..BIsolated β-bridgetrans-84.2134.5179.3-62.8-72.4000113Y105 Y106 R116 R118 R119 E120 G129Y105-F131 HydrophobicContact CD2-CB 4.47Å; Y105-F131 AromaticContact CD2-CD2 3.52Å; Y105-F131 HydrophobicContact CD2-CD2 3.52Å; Y105-F131 HydrophobicContact CD2-CE2 4.08Å; Y105-F131 HydrophobicContact CD2-CG 4.19Å; Y105-F131 HydrophobicContact CE2-CD2 4.25Å; Y105-F131 AromaticContact CG-CD2 3.94Å; Y105-F131 HydrophobicContact CG-CD2 3.94Å; Y105-F131 HydrophobicContact CG-CE2 4.4Å; Y105-F131 HydrophobicContact CG-CG 4.28Å; Y106-F131 HydrophobicContact CE1-CE2 4.35Å; Y106-F131 AromaticContact CE1-CZ 3.81Å; Y106-F131 HydrophobicContact CE1-CZ 3.81Å; Y106-F131 AromaticContact CE2-CE2 3.98Å; Y106-F131 HydrophobicContact CE2-CE2 3.98Å; Y106-F131 HydrophobicContact CE2-CZ 4.24Å; Y106-F131 AromaticContact CZ-CE2 3.62Å; Y106-F131 AromaticContact CZ-CZ 3.54Å; Y106-F131 VanDerWaalsContact OH-CE2 3.28Å; Y106-F131 WeakPolarHBondContact OH-CE2 3.34Å; Y106-F131 WeakPolarHBondContact OH-CZ 3.25Å; R116-F131 HydrophobicContact CB-CE1 4.14Å; R116-F131 HydrophobicContact CG-CE1 4.24Å; R116-F131 HydrophobicContact CG-CZ 4.33Å; R118-F131 HydrophobicContact CB-CB 3.94Å; R118-F131 HydrophobicContact CB-CD1 3.7Å; R118-F131 HydrophobicContact CB-CG 4.08Å; R118-F131 WeakPolarHBondContact O-CD1 3.47Å; R119-F131 WeakPolarHBondContact O-CA 3.31Å; E120-F131 HydrophobicContact CG-CD1 3.99Å; E120-F131 HydrophobicContact CG-CE1 3.82Å; G129-F131 WeakPolarHBondContact O-CD2 3.41Å; G129-F131 PolarHBondContact O-N 3.41Å
132M93.9Very high90.9Very high0 Ų062.4 Ų62.40%037%0.368CS..PPolyproline II helixtrans-74.1137.4169.9-57.1-174.581.100110.2R118 R119 C121 H139 Y140 C141 L146 Y148R118-M132 WeakPolarHBondContact CD-O 3.21Å; R119-M132 HydrophobicContact CG-SD 4.39Å; R119-M132 PolarHBondContact O-N 3.34Å; C121-M132 HydrophobicContact CB-CG 4.19Å; M132-H139 HydrophobicContact CB-CB 4.22Å; M132-H139 HydrophobicContact CE-CB 4.15Å; M132-H139 WeakPolarHBondContact CE-O 3.49Å; M132-H139 HydrophobicContact SD-CB 4.28Å; M132-Y140 CarbonylContact C-O 3.46Å; M132-Y140 WeakPolarHBondContact CA-O 3.39Å; M132-C141 HydrophobicContact CE-CB 4.17Å; M132-C141 HydrophobicContact CG-CB 4.28Å; M132-L146 HydrophobicContact CE-CD2 4.48Å; M132-L146 HydrophobicContact CE-CG 4.38Å; M132-L146 VanDerWaalsContact CE-O 3.3Å; M132-L146 WeakPolarHBondContact CE-O 3.3Å; M132-Y148 HydrophobicContact CE-CD2 3.76Å; M132-Y148 HydrophobicContact CE-CE2 4.24Å; M132-Y148 HydrophobicContact SD-CD2 3.97Å; M132-Y148 HydrophobicContact SD-CE2 4.25Å
133A93.7Very high91Very high28 Ų2865.5 Ų65.523%0.23137%0.374CS..EExtended strand (participates in β ladder)trans-66.7130.6169.600000109.8H139 Y140A133-H139 CarbonylContact O-C 3.2Å; A133-H139 VanDerWaalsContact O-CA 3.25Å; A133-H139 WeakPolarHBondContact O-CA 3.48Å; A133-Y140 PolarHBondContact N-O 3.4Å; A133-Y140 PolarHBondContact O-N 2.68Å
134S92.4Very high91.2Very high69 Ų6966 Ų6648%0.48338%0.375SS..EExtended strand (participates in β ladder)trans-92.5103.8173.5-169.60000108.6H139S134-H139 PolarHBondContact OG-NE2 2.97Å
135H93.4Very high91.4Very high82 Ų8261.5 Ų61.538%0.3836%0.356SS..  trans-91.5174.2168.2-63-83.6000109.4D137 R138H135-D137 VanDerWaalsContact C-N 3.27Å; H135-D137 PolarHBondContact O-N 3.05Å; H135-R138 WeakPolarHBondContact CA-O 3.3Å; H135-R138 HydrophobicContact CB-CG 3.93Å; H135-R138 WeakPolarHBondContact CB-O 3.37Å; H135-R138 PolarHBondContact N-O 3.43Å
136F91.7Very high91.6Very high173 Ų17356.6 Ų56.676%0.75934%0.335SS*.SBendtrans-65.2-30.1-175.973.9-85.2000113.6
137D91.8Very high92.1Very high26 Ų2659.5 Ų59.514%0.13935%0.353CS..SBendtrans-111.3-22.1-174.456-28.2000113.4H135 C149 F150 N151H135-D137 VanDerWaalsContact C-N 3.27Å; H135-D137 PolarHBondContact O-N 3.05Å; D137-C149 WeakPolarHBondContact O-CA 3.41Å; D137-F150 PolarHBondContact O-N 2.9Å; D137-N151 PolarHBondContact O-N 3.22Å
138R93.8Very high92.8Very high97 Ų9761.7 Ų61.737%0.36635%0.349SS..EExtended strand (participates in β ladder)trans-151.3156.6-166.369-165.2178.3-132.212.3114.5H135 T147 Y148 F150H135-R138 WeakPolarHBondContact CA-O 3.3Å; H135-R138 HydrophobicContact CB-CG 3.93Å; H135-R138 WeakPolarHBondContact CB-O 3.37Å; H135-R138 PolarHBondContact N-O 3.43Å; R138-T147 HydrophobicContact CB-CG2 3.95Å; R138-T147 HydrophobicContact CG-CG2 4.17Å; R138-Y148 CarbonylContact C-O 3.48Å; R138-Y148 WeakPolarHBondContact CA-O 3.43Å; R138-Y148 WeakPolarHBondContact CB-O 3.25Å; R138-F150 VanDerWaalsContact C-CE1 3.48Å
139H94.6Very high93.1Very high39 Ų3961.5 Ų61.518%0.18134%0.341CS..EExtended strand (participates in β ladder)trans-99.4129.3162.7-69.895.3000109.6M132 A133 S134 T147 Y148 F150M132-H139 HydrophobicContact CB-CB 4.22Å; M132-H139 HydrophobicContact CE-CB 4.15Å; M132-H139 WeakPolarHBondContact CE-O 3.49Å; M132-H139 HydrophobicContact SD-CB 4.28Å; A133-H139 CarbonylContact O-C 3.2Å; A133-H139 VanDerWaalsContact O-CA 3.25Å; A133-H139 WeakPolarHBondContact O-CA 3.48Å; S134-H139 PolarHBondContact OG-NE2 2.97Å; H139-T147 CarbonylContact O-C 3.5Å; H139-T147 VanDerWaalsContact O-CA 3.3Å; H139-T147 WeakPolarHBondContact O-CA 3.28Å; H139-Y148 PolarHBondContact N-O 3.12Å; H139-Y148 PolarHBondContact O-N 2.77Å; H139-F150 AromaticContact CE1-CD1 3.63Å; H139-F150 AromaticContact CE1-CE1 3.25Å; H139-F150 WeakPolarHBondContact CE1-CE1 3.49Å; H139-F150 AromaticContact ND1-CD1 3.3Å; H139-F150 VanDerWaalsContact ND1-CD1 3.3Å; H139-F150 WeakPolarHBondContact ND1-CD1 3.49Å; H139-F150 AromaticContact ND1-CE1 3.21Å; H139-F150 WeakPolarHBondContact ND1-CE1 3.3Å
140Y95.4Very high93.1Very high73 Ų7364.3 Ų64.329%0.28634%0.343SS..EExtended strand (participates in β ladder)trans-126.7125.1-175.2172.7-103.9000111.9M132 A133 C145 L146 T147M132-Y140 CarbonylContact C-O 3.46Å; M132-Y140 WeakPolarHBondContact CA-O 3.39Å; A133-Y140 PolarHBondContact N-O 3.4Å; A133-Y140 PolarHBondContact O-N 2.68Å; Y140-C145 HydrophobicContact CE2-CB 4.06Å; Y140-C145 PolarHBondContact OH-SG 3.07Å; Y140-C145 VanDerWaalsContact OH-SG 3.4Å; Y140-L146 CarbonylContact C-O 3.53Å; Y140-L146 WeakPolarHBondContact CA-O 3.35Å; Y140-T147 WeakPolarHBondContact CD2-OG1 3.43Å
141C95Very high92.4Very high0 Ų067.4 Ų67.40%036%0.358CS..  trans-82118.9172.5-175.20000110.6C121 M132 K143 C145 L146C121-C141 HydrophobicContact CB-CB 4.31Å; M132-C141 HydrophobicContact CE-CB 4.17Å; M132-C141 HydrophobicContact CG-CB 4.28Å; C141-K143 PolarHBondContact O-N 2.78Å; C141-K143 PolarHBondContact SG-N 2.82Å; C141-C145 WeakPolarHBondContact O-CA 3.38Å; C141-C145 PolarHBondContact O-N 3.16Å; C141-L146 HydrophobicContact CB-CB 4.15Å; C141-L146 PolarHBondContact N-O 3.13Å
142G92.9Very high91.3Very high64 Ų6475 Ų7566%0.6639%0.391SS*.THydrogen-bonded Turntrans-70.2-10.7177.100000115.2
143K93.6Very high90.2Very high137 Ų13780.2 Ų80.260%0.59643%0.425SS*.THydrogen-bonded Turntrans-97.2-55.1-177.4-172.2179.4176.7-161.50112.4E125 V130 C141E125-K143 PolarHBondContact O-NZ 2.89Å; V130-K143 HydrophobicContact CG1-CB 4.26Å; V130-K143 HydrophobicContact CG2-CD 4.36Å; C141-K143 PolarHBondContact O-N 2.78Å; C141-K143 PolarHBondContact SG-N 2.82Å
144C95Very high89.1Confident40 Ų4087.7 Ų87.727%0.2746%0.455SS..THydrogen-bonded Turntrans-102.63.3-179.663.90000114.5C121 C126 L146C121-C144 PolarHBondContact SG-SG 3.43Å; C126-C144 VanDerWaalsContact SG-CB 3.51Å; C144-L146 PolarHBondContact O-N 3.16Å; C144-L146 VanDerWaalsContact O-N 3.1Å; C144-L146 VanDerWaalsContact SG-CB 3.53Å
145C94.8Very high88Confident77 Ų7792.6 Ų92.652%0.5248%0.476SS..  trans63.510.4-177.9-52.90000115.5Y140 C141 T147Y140-C145 HydrophobicContact CE2-CB 4.06Å; Y140-C145 PolarHBondContact OH-SG 3.07Å; Y140-C145 VanDerWaalsContact OH-SG 3.4Å; C141-C145 WeakPolarHBondContact O-CA 3.38Å; C141-C145 PolarHBondContact O-N 3.16Å; C145-T147 PolarHBondContact O-N 2.97Å; C145-T147 PolarHBondContact O-OG1 3.18Å
146L93.5Very high86.1Confident55 Ų55101.7 Ų101.729%0.28852%0.515SS..  trans-59.9132.5176.2-17767.8000111P122 M132 Y140 C141 C144 Y148P122-L146 HydrophobicContact CG-CD2 3.84Å; M132-L146 HydrophobicContact CE-CD2 4.48Å; M132-L146 HydrophobicContact CE-CG 4.38Å; M132-L146 VanDerWaalsContact CE-O 3.3Å; M132-L146 WeakPolarHBondContact CE-O 3.3Å; Y140-L146 CarbonylContact C-O 3.53Å; Y140-L146 WeakPolarHBondContact CA-O 3.35Å; C141-L146 HydrophobicContact CB-CB 4.15Å; C141-L146 PolarHBondContact N-O 3.13Å; C144-L146 PolarHBondContact O-N 3.16Å; C144-L146 VanDerWaalsContact O-N 3.1Å; C144-L146 VanDerWaalsContact SG-CB 3.53Å; L146-Y148 HydrophobicContact CD2-CE2 3.86Å; L146-Y148 HydrophobicContact CG-CE2 4.36Å
147T94.2Very high85.8Confident61 Ų6198.2 Ų98.237%0.37450%0.502SS..EExtended strand (participates in β ladder)trans-126.6130-176.8-54.70000111R138 H139 Y140 C145R138-T147 HydrophobicContact CB-CG2 3.95Å; R138-T147 HydrophobicContact CG-CG2 4.17Å; H139-T147 CarbonylContact O-C 3.5Å; H139-T147 VanDerWaalsContact O-CA 3.3Å; H139-T147 WeakPolarHBondContact O-CA 3.28Å; Y140-T147 WeakPolarHBondContact CD2-OG1 3.43Å; C145-T147 PolarHBondContact O-N 2.97Å; C145-T147 PolarHBondContact O-OG1 3.18Å
148Y92.2Very high85.5Confident86 Ų86101.9 Ų101.934%0.33752%0.522SS..EExtended strand (participates in β ladder)trans-115.9111.8168.4-70.5-61.2000109.7P122 M132 R138 H139 L146P122-Y148 HydrophobicContact CG-CE2 3.87Å; P122-Y148 VanDerWaalsContact CG-OH 3.31Å; P122-Y148 WeakPolarHBondContact CG-OH 3.46Å; M132-Y148 HydrophobicContact CE-CD2 3.76Å; M132-Y148 HydrophobicContact CE-CE2 4.24Å; M132-Y148 HydrophobicContact SD-CD2 3.97Å; M132-Y148 HydrophobicContact SD-CE2 4.25Å; R138-Y148 CarbonylContact C-O 3.48Å; R138-Y148 WeakPolarHBondContact CA-O 3.43Å; R138-Y148 WeakPolarHBondContact CB-O 3.25Å; H139-Y148 PolarHBondContact N-O 3.12Å; H139-Y148 PolarHBondContact O-N 2.77Å; L146-Y148 HydrophobicContact CD2-CE2 3.86Å; L146-Y148 HydrophobicContact CG-CE2 4.36Å
149C90.7Very high85Confident85 Ų85102.2 Ų102.257%0.57453%0.53SS*.EExtended strand (participates in β ladder)trans-84.9129171.6-57.60000109.1D137D137-C149 WeakPolarHBondContact O-CA 3.41Å
150F87.3Confident84.4Confident97 Ų97105.9 Ų105.943%0.42555%0.551SS.*  trans-114.5-27178.853.6-93.5000112.6D137 R138 H139D137-F150 PolarHBondContact O-N 2.9Å; R138-F150 VanDerWaalsContact C-CE1 3.48Å; H139-F150 AromaticContact CE1-CD1 3.63Å; H139-F150 AromaticContact CE1-CE1 3.25Å; H139-F150 WeakPolarHBondContact CE1-CE1 3.49Å; H139-F150 AromaticContact ND1-CD1 3.3Å; H139-F150 VanDerWaalsContact ND1-CD1 3.3Å; H139-F150 WeakPolarHBondContact ND1-CD1 3.49Å; H139-F150 AromaticContact ND1-CE1 3.21Å; H139-F150 WeakPolarHBondContact ND1-CE1 3.3Å
151N78.2Confident83.7Confident101 Ų101108 Ų10854%0.5457%0.567SS.*SBendtrans-105.9101.3166.7-71.7-16.5000107.4D137D137-N151 PolarHBondContact O-N 3.22Å
152K69.7Low83Confident184 Ų184115.2 Ų115.280%0.861%0.605SS**PPolyproline II helixtrans-69.2132164.6-68.4-178.2-178.4177.10106.8E154K152-E154 PolarHBondContact O-N 2.95Å
153P70.9Confident82.3Confident111 Ų111118.9 Ų118.972%0.72160%0.601SS**PPolyproline II helixtrans-57131.3166.525.2-30.5000107.5D155P153-D155 PolarHBondContact O-N 3.37Å
154E70.8Confident81.4Confident185 Ų185117.5 Ų117.586%0.86460%0.602SS**PPolyproline II helixtrans-54.5123165.7-68.5174.2168.400106.6K152 K156K152-E154 PolarHBondContact O-N 2.95Å; E154-K156 PolarHBondContact O-N 3.33Å
155D68.2Low80.3Confident171 Ų171123.9 Ų123.991%0.91463%0.629SS**  trans-55.5113.1176.9-71.7-48.2000107.6P153P153-D155 PolarHBondContact O-N 3.37Å
156K53.2Low79Confident274 Ų274128.2 Ų128.2100%1.19164%0.639SS**  trans-83.40171.8-81.5-170.5177.2-1760110.6E154E154-K156 PolarHBondContact O-N 3.33Å

Retrieved 156 of 156 residues in 871.6 ms (Link to these results)

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